1 72626724240 1 3 1000 7 s 2 p 3 p 0 f 0 h 0 s 0 d 0 s 2 p 2 p 1 f 0 h 0 s 0 d 0 s 2 p 2 p 1 f 0 h 0 s 0 d 0 s 2 p 2 p 1 f 0 h 0 s 0 d 0 s 2 p 2 p 1 f 0 h 0 s 0 d 0 s 2 p 2 p 1 f 0 h 0 s 0 d 0 s 2 p 2 p 0 f 1 h 0 s 0 d 0 s 2 p 2 p 0 f 1 h 0 s 0 d 0 s 2 p 2 p 0 f 1 h 0 s 0 d 0 s 2 p 2 p 0 f 1 h 0 s 0 d 0 s 2 p 2 p 0 f 1 h 0 s 0 d 0 s 2 p 2 p 0 f 1 h 0 s 0 d 0 s 2 p 2 p 0 f 0 h 1 s 0 d 0 s 2 p 2 p 0 f 0 h 1 s 0 d 0 s 2 p 2 p 0 f 0 h 1 s 0 d 0 s 1 p 3 p 0 f 0 h 0 s 1 d 0 s 1 p 3 p 0 f 0 h 0 s 1 d 0 s 1 p 3 p 0 f 0 h 0 s 1 d 0 s 1 p 3 p 0 f 0 h 0 s 1 d 0 s 1 p 3 p 0 f 0 h 0 s 1 d 0 s 1 p 3 p 0 f 0 h 0 s 0 d 1 s 1 p 3 p 0 f 0 h 0 s 0 d 1 s 1 p 3 p 0 f 0 h 0 s 0 d 1 s 1 p 3 p 0 f 0 h 0 s 0 d 1 s 1 p 3 p 0 f 0 h 0 s 0 d 1 s 0 p 5 p 0 f 0 h 0 s 0 d 0 s 2 p 2 s 1 d 0 g 0 p 0 f 0 s 2 p 2 s 1 d 0 g 0 p 0 f 0 s 2 p 2 s 1 d 0 g 0 p 0 f 0 s 2 p 2 s 1 d 0 g 0 p 0 f 0 s 2 p 2 s 1 d 0 g 0 p 0 f 0 s 2 p 2 s 0 d 1 g 0 p 0 f 0 s 2 p 2 s 0 d 1 g 0 p 0 f 0 s 2 p 2 s 0 d 1 g 0 p 0 f 0 s 2 p 2 s 0 d 1 g 0 p 0 f 0 s 2 p 2 s 0 d 1 g 0 p 0 f 0 s 2 p 2 s 0 d 1 g 0 p 0 f 0 s 2 p 2 s 0 d 0 g 1 p 0 f 0 s 2 p 2 s 0 d 0 g 1 p 0 f 0 s 2 p 2 s 0 d 0 g 1 p 0 f 0 s 1 p 4 s 0 d 0 g 0 p 0 f 0 s 1 p 3 s 0 d 0 g 0 p 1 f 0 s 1 p 3 s 0 d 0 g 0 p 1 f 0 s 1 p 3 s 0 d 0 g 0 p 1 f 0 s 1 p 3 s 0 d 0 g 0 p 1 f 0 s 1 p 3 s 0 d 0 g 0 p 1 f 0 s 1 p 3 s 0 d 0 g 0 p 0 f 1 s 1 p 3 s 0 d 0 g 0 p 0 f 1 s 1 p 3 s 0 d 0 g 0 p 0 f 1 s 1 p 3 s 0 d 0 g 0 p 0 f 1 as i s2p3 3 0.00000 39.08961 1.43622 0.00000 0.00000xr99999999 as i s2p2 5p 7 55.51520 43.53291 1.75372 .11162 4.81923xr99999999 1.90184 1.68364 as i s2p2 6p 7 64.82740 43.73591 1.76712 .04172 1.59823xr99999999 .63654 .58564 as i s2p2 7p 7 68.40110 43.79311 1.77102 .02022 .73113xr99999999 .29354 .27474 as i s2p2 8p 7 70.18400 43.81501 1.77252 .01122 .39623xr99999999 .15994 .15104 as i s2p2 9p 7 71.20600 43.82521 1.77322 .00692 .23913xr99999999 .09684 .09194 as i s2p2 4f 7 66.82880 43.83741 1.77422 .00002 .53033xr99999999 .01844 .01194 as i s2p2 5f 7 69.32910 43.83801 1.77422 .00002 .27663xr99999999 .01604 .01034 as i s2p2 6f 7 70.69230 43.83871 1.77432 .00002 .16263xr99999999 .01194 .00764 as i s2p2 7f 7 71.51520 43.83921 1.77432 .00002 .10373xr99999999 .00864 .00564 as i s2p2 8f 7 72.04840 43.83961 1.77432 .00002 .07023xr99999999 .00634 .00414 as i s2p2 9f 7 72.41330 43.83981 1.77432 .00002 .04973xr99999999 .00484 .00314 as i s2p2 6h 7 70.73190 43.84041 1.77432 .00002 .03953xr99999999 .00004 .00004 as i s2p2 7h 7 71.54080 43.84041 1.77432 .00002 .02493xr99999999 .00004 .00004 as i s2p2 8h 7 72.06570 43.84041 1.77432 .00002 .01663xr99999999 .00004 .00004 as i sp3 5s 6 126.57240 43.88571 1.81452 60.16944 2.22134xr99999999 3.00704 as i sp3 6s 6 143.07980 44.51231 1.85012 60.84694 .57674xr99999999 .70464 as i sp3 7s 6 148.34390 44.62961 1.85742 60.97804 .23204xr99999999 .27864 as i sp3 8s 6 150.75800 44.66741 1.85992 61.02074 .11634xr99999999 .13874 as i sp3 9s 6 152.06930 44.68341 1.86092 61.03894 .06654xr99999999 .07914 as i sp3 4d 9 140.09200 44.29761 1.83942 .00652 6.19063xr99999999 60.61894 1.61894 4.13194 2.42724 as i sp3 5d 9 147.02760 44.50971 1.85052 .00392 2.68993xr99999999 60.84434 .93214 2.17534 1.29634 as i sp3 6d 9 150.08900 44.61001 1.85632 .00212 1.29493xr99999999 60.95544 .49474 1.10904 .66554 as i sp3 7d 9 151.68510 44.65301 1.85902 .00122 .70553xr99999999 61.00404 .28224 .61914 .37304 as i sp3 8d 9 152.62110 44.67361 1.86032 .00082 .42343xr99999999 61.02754 .17384 .37634 .22734 as i p5 2 182.02980 1.64822 0.00000 0.00000 0.00000xr99999999 s2p3 -s2p2 5p 2 1.35525 5.84585 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 6p 2 .76565 3.25415 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 7p 2 .51425 2.17335 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 8p 2 .37725 1.59015 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 9p 2 .29255 1.23085 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 4f 1 .68835 0.00005 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 5f 1 .65185 0.00005 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 6f 1 .56505 0.00005 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 7f 1 .48385 0.00005 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 8f 1 .41625 0.00005 0.00005 0.00005 0.00005xr99999999 s2p3 -s2p2 9f 1 .36135 0.00005 0.00005 0.00005 0.00005xr99999999 s2p3 -sp3 5s 3 3.13195 -.72145 .05585 0.00005 0.00005xr99999999 s2p3 -sp3 6s 3 1.57125 -.26345 .03995 0.00005 0.00005xr99999999 s2p3 -sp3 7s 3 .98925 -.15965 .02455 0.00005 0.00005xr99999999 s2p3 -sp3 8s 3 .69755 -.11205 .01685 0.00005 0.00005xr99999999 s2p3 -sp3 9s 3 .52645 -.08445 .01245 0.00005 0.00005xr99999999 s2p3 -sp3 4d 2 14.51335 8.46015 0.00005 0.00005 0.00005xr99999999 s2p3 -sp3 5d 2 10.62575 6.42775 0.00005 0.00005 0.00005xr99999999 s2p3 -sp3 6d 2 7.60915 4.68425 0.00005 0.00005 0.00005xr99999999 s2p3 -sp3 7d 2 5.69125 3.53795 0.00005 0.00005 0.00005xr99999999 s2p3 -sp3 8d 2 4.43875 2.77615 0.00005 0.00005 0.00005xr99999999 s2p3 -p5 1 57.65355 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 5p -s2p2 6p 4 0.00005 2.33485 1.09865 .98985 0.00005xr99999999 s2p2 5p -s2p2 7p 4 0.00005 1.50895 .74495 .67585 0.00005xr99999999 s2p2 5p -s2p2 8p 4 0.00005 1.08785 .54935 .50025 0.00005xr99999999 s2p2 5p -s2p2 9p 4 0.00005 .83485 .42715 .38985 0.00005xr99999999 s2p2 5p -s2p2 4f 2 -.91145 .02275 0.00005 0.00005 0.00005xr99999999 s2p2 5p -s2p2 5f 2 -.71485 .02485 0.00005 0.00005 0.00005xr99999999 s2p2 5p -s2p2 6f 2 -.56025 .02295 0.00005 0.00005 0.00005xr99999999 s2p2 5p -s2p2 7f 2 -.45095 .02045 0.00005 0.00005 0.00005xr99999999 s2p2 5p -s2p2 8f 2 -.37215 .01805 0.00005 0.00005 0.00005xr99999999 s2p2 5p -s2p2 9f 2 -.31365 .01595 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 5s 2 9.78345 1.80595 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 6s 2 1.06165 .91035 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 7s 2 .58995 .57355 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 8s 2 .38645 .40455 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 9s 2 .27855 .30535 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 4d 2 -5.12875 1.15395 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 5d 2 -.73755 .91275 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 6d 2 .07735 .67765 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 7d 2 .26515 .51685 0.00005 0.00005 0.00005xr99999999 s2p2 5p -sp3 8d 2 .29795 .40795 0.00005 0.00005 0.00005xr99999999 s2p2 6p -s2p2 7p 4 0.00005 1.00825 .43215 .40085 0.00005xr99999999 s2p2 6p -s2p2 8p 4 0.00005 .72445 .31885 .29705 0.00005xr99999999 s2p2 6p -s2p2 9p 4 0.00005 .55555 .24805 .23175 0.00005xr99999999 s2p2 6p -s2p2 4f 2 -.07425 .00815 0.00005 0.00005 0.00005xr99999999 s2p2 6p -s2p2 5f 2 -.19805 .00955 0.00005 0.00005 0.00005xr99999999 s2p2 6p -s2p2 6f 2 -.19155 .00915 0.00005 0.00005 0.00005xr99999999 s2p2 6p -s2p2 7f 2 -.16865 .00835 0.00005 0.00005 0.00005xr99999999 s2p2 6p -s2p2 8f 2 -.14615 .00745 0.00005 0.00005 0.00005xr99999999 s2p2 6p -s2p2 9f 2 -.12695 .00665 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 5s 2 5.02535 1.06425 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 6s 2 2.82275 .53755 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 7s 2 .59595 .33895 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 8s 2 .38515 .23915 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 9s 2 .27445 .18055 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 4d 2 -1.46755 .63045 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 5d 2 -1.85305 .50135 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 6d 2 -.58565 .37315 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 7d 2 -.23785 .28495 0.00005 0.00005 0.00005xr99999999 s2p2 6p -sp3 8d 2 -.10315 .22515 0.00005 0.00005 0.00005xr99999999 s2p2 7p -s2p2 8p 4 0.00005 .51965 .21665 .20365 0.00005xr99999999 s2p2 7p -s2p2 9p 4 0.00005 .39795 .16855 .15895 0.00005xr99999999 s2p2 7p -s2p2 4f 2 -.06935 .00415 0.00005 0.00005 0.00005xr99999999 s2p2 7p -s2p2 5f 2 -.05565 .00525 0.00005 0.00005 0.00005xr99999999 s2p2 7p -s2p2 6f 2 -.07815 .00515 0.00005 0.00005 0.00005xr99999999 s2p2 7p -s2p2 7f 2 -.07685 .00465 0.00005 0.00005 0.00005xr99999999 s2p2 7p -s2p2 8f 2 -.07035 .00425 0.00005 0.00005 0.00005xr99999999 s2p2 7p -s2p2 9f 2 -.06305 .00375 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 5s 2 3.29685 .72795 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 6s 2 1.84425 .36805 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 7s 2 1.16195 .23215 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 8s 2 .34965 .16385 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 9s 2 .24645 .12365 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 4d 2 -.86355 .41765 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 5d 2 -.77025 .33285 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 6d 2 -.85605 .24805 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 7d 2 -.37065 .18955 0.00005 0.00005 0.00005xr99999999 s2p2 7p -sp3 8d 2 -.20725 .14975 0.00005 0.00005 0.00005xr99999999 s2p2 8p -s2p2 9p 4 0.00005 .30165 .12445 .11785 0.00005xr99999999 s2p2 8p -s2p2 4f 2 -.05005 .00255 0.00005 0.00005 0.00005xr99999999 s2p2 8p -s2p2 5f 2 -.04825 .00335 0.00005 0.00005 0.00005xr99999999 s2p2 8p -s2p2 6f 2 -.03785 .00335 0.00005 0.00005 0.00005xr99999999 s2p2 8p -s2p2 7f 2 -.04155 .00305 0.00005 0.00005 0.00005xr99999999 s2p2 8p -s2p2 8f 2 -.03985 .00275 0.00005 0.00005 0.00005xr99999999 s2p2 8p -s2p2 9f 2 -.03675 .00255 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 5s 2 2.39395 .53945 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 6s 2 1.34375 .27275 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 7s 2 .85215 .17205 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 8s 2 .58395 .12145 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 9s 2 .21935 .09175 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 4d 2 -.59555 .30425 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 5d 2 -.50725 .24275 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 6d 2 -.42585 .18095 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 7d 2 -.46215 .13835 0.00005 0.00005 0.00005xr99999999 s2p2 8p -sp3 8d 2 -.23945 .10935 0.00005 0.00005 0.00005xr99999999 s2p2 9p -s2p2 4f 2 -.03795 .00175 0.00005 0.00005 0.00005xr99999999 s2p2 9p -s2p2 5f 2 -.03715 .00245 0.00005 0.00005 0.00005xr99999999 s2p2 9p -s2p2 6f 2 -.03245 .00245 0.00005 0.00005 0.00005xr99999999 s2p2 9p -s2p2 7f 2 -.02595 .00225 0.00005 0.00005 0.00005xr99999999 s2p2 9p -s2p2 8f 2 -.02565 .00205 0.00005 0.00005 0.00005xr99999999 s2p2 9p -s2p2 9f 2 -.02405 .00185 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 5s 2 1.84505 .42065 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 6s 2 1.03865 .21285 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 7s 2 .66255 .13425 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 8s 2 .45805 .09475 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 9s 2 .33305 .07155 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 4d 2 -.44525 .23485 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 5d 2 -.37285 .18755 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 6d 2 -.30035 .13985 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 7d 2 -.25715 .10695 0.00005 0.00005 0.00005xr99999999 s2p2 9p -sp3 8d 2 -.27715 .08455 0.00005 0.00005 0.00005xr99999999 s2p2 4f -s2p2 5f 4 0.00005 .31155 .01725 .01115 0.00005xr99999999 s2p2 4f -s2p2 6f 4 0.00005 .22065 .01485 .00955 0.00005xr99999999 s2p2 4f -s2p2 7f 4 0.00005 .16885 .01265 .00815 0.00005xr99999999 s2p2 4f -s2p2 8f 4 0.00005 .13525 .01085 .00695 0.00005xr99999999 s2p2 4f -s2p2 9f 4 0.00005 .11185 .00935 .00605 0.00005xr99999999 s2p2 4f -s2p2 6h 2 .06215 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 4f -s2p2 7h 2 .06045 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 4f -s2p2 8h 2 .05385 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 4f -sp3 4d 2 2.69755 .13925 0.00005 0.00005 0.00005xr99999999 s2p2 4f -sp3 5d 2 -.46035 .10165 0.00005 0.00005 0.00005xr99999999 s2p2 4f -sp3 6d 2 -.09255 .07275 0.00005 0.00005 0.00005xr99999999 s2p2 4f -sp3 7d 2 -.05645 .05445 0.00005 0.00005 0.00005xr99999999 s2p2 4f -sp3 8d 2 -.04215 .04245 0.00005 0.00005 0.00005xr99999999 s2p2 5f -s2p2 6f 4 0.00005 .19525 .01385 .00895 0.00005xr99999999 s2p2 5f -s2p2 7f 4 0.00005 .14995 .01185 .00765 0.00005xr99999999 s2p2 5f -s2p2 8f 4 0.00005 .12055 .01015 .00655 0.00005xr99999999 s2p2 5f -s2p2 9f 4 0.00005 .09985 .00875 .00565 0.00005xr99999999 s2p2 5f -s2p2 6h 2 -.01485 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 5f -s2p2 7h 2 .00205 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 5f -s2p2 8h 2 .00815 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 5f -sp3 4d 2 2.02435 .13255 0.00005 0.00005 0.00005xr99999999 s2p2 5f -sp3 5d 2 .44485 .09705 0.00005 0.00005 0.00005xr99999999 s2p2 5f -sp3 6d 2 -.30865 .06945 0.00005 0.00005 0.00005xr99999999 s2p2 5f -sp3 7d 2 -.08225 .05195 0.00005 0.00005 0.00005xr99999999 s2p2 5f -sp3 8d 2 -.05205 .04055 0.00005 0.00005 0.00005xr99999999 s2p2 6f -s2p2 7f 4 0.00005 .12445 .01015 .00655 0.00005xr99999999 s2p2 6f -s2p2 8f 4 0.00005 .10015 .00875 .00565 0.00005xr99999999 s2p2 6f -s2p2 9f 4 0.00005 .08315 .00755 .00485 0.00005xr99999999 s2p2 6f -s2p2 6h 2 -.00005 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 6f -s2p2 7h 2 -.00675 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 6f -s2p2 8h 2 -.00295 .00015 0.00005 0.00005 0.00005xr99999999 s2p2 6f -sp3 4d 2 1.56695 .11525 0.00005 0.00005 0.00005xr99999999 s2p2 6f -sp3 5d 2 .49775 .08445 0.00005 0.00005 0.00005xr99999999 s2p2 6f -sp3 6d 2 .02885 .06045 0.00005 0.00005 0.00005xr99999999 s2p2 6f -sp3 7d 2 -.19635 .04525 0.00005 0.00005 0.00005xr99999999 s2p2 6f -sp3 8d 2 -.06435 .03535 0.00005 0.00005 0.00005xr99999999 s2p2 7f -s2p2 8f 4 0.00005 .08325 .00745 .00485 0.00005xr99999999 s2p2 7f -s2p2 9f 4 0.00005 .06915 .00645 .00415 0.00005xr99999999 s2p2 7f -s2p2 6h 2 .00025 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 7f -s2p2 7h 2 -.00015 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 7f -s2p2 8h 2 -.00315 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 7f -sp3 4d 2 1.25595 .09885 0.00005 0.00005 0.00005xr99999999 s2p2 7f -sp3 5d 2 .45505 .07245 0.00005 0.00005 0.00005xr99999999 s2p2 7f -sp3 6d 2 .10045 .05195 0.00005 0.00005 0.00005xr99999999 s2p2 7f -sp3 7d 2 -.04735 .03885 0.00005 0.00005 0.00005xr99999999 s2p2 7f -sp3 8d 2 -.12865 .03035 0.00005 0.00005 0.00005xr99999999 s2p2 8f -s2p2 9f 4 0.00005 .05815 .00555 .00355 0.00005xr99999999 s2p2 8f -s2p2 6h 2 .00025 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 8f -s2p2 7h 2 .00015 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 8f -s2p2 8h 2 -.00005 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 8f -sp3 4d 2 1.03525 .08515 0.00005 0.00005 0.00005xr99999999 s2p2 8f -sp3 5d 2 .40115 .06245 0.00005 0.00005 0.00005xr99999999 s2p2 8f -sp3 6d 2 .11685 .04475 0.00005 0.00005 0.00005xr99999999 s2p2 8f -sp3 7d 2 -.00105 .03355 0.00005 0.00005 0.00005xr99999999 s2p2 8f -sp3 8d 2 -.05395 .02615 0.00005 0.00005 0.00005xr99999999 s2p2 9f -s2p2 6h 2 .00025 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 9f -s2p2 7h 2 .00025 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 9f -s2p2 8h 2 .00005 .00005 0.00005 0.00005 0.00005xr99999999 s2p2 9f -sp3 4d 2 .87235 .07395 0.00005 0.00005 0.00005xr99999999 s2p2 9f -sp3 5d 2 .35205 .05425 0.00005 0.00005 0.00005xr99999999 s2p2 9f -sp3 6d 2 .11625 .03895 0.00005 0.00005 0.00005xr99999999 s2p2 9f -sp3 7d 2 .01785 .02915 0.00005 0.00005 0.00005xr99999999 s2p2 9f -sp3 8d 2 -.02555 .02275 0.00005 0.00005 0.00005xr99999999 s2p2 6h -s2p2 7h 4 0.00005 .02255 .00005 .00005 0.00005xr99999999 s2p2 6h -s2p2 8h 4 0.00005 .01585 .00005 .00005 0.00005xr99999999 s2p2 7h -s2p2 8h 4 0.00005 .01745 .00005 .00005 0.00005xr99999999 sp3 5s -sp3 6s 4 0.00005 1.13115 0.00005 1.43495 0.00005xr99999999 sp3 5s -sp3 7s 4 0.00005 .71705 0.00005 .89475 0.00005xr99999999 sp3 5s -sp3 8s 4 0.00005 .50745 0.00005 .62875 0.00005xr99999999 sp3 5s -sp3 9s 4 0.00005 .38365 0.00005 .47365 0.00005xr99999999 sp3 5s -sp3 4d 2 -5.61365 -1.35745 0.00005 0.00005 0.00005xr99999999 sp3 5s -sp3 5d 2 -3.14035 -.85995 0.00005 0.00005 0.00005xr99999999 sp3 5s -sp3 6d 2 -1.95215 -.56875 0.00005 0.00005 0.00005xr99999999 sp3 5s -sp3 7d 2 -1.34255 -.40645 0.00005 0.00005 0.00005xr99999999 sp3 5s -sp3 8d 2 -.99175 -.30805 0.00005 0.00005 0.00005xr99999999 sp3 5s -p5 1 .84985 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 6s -sp3 7s 4 0.00005 .36585 0.00005 .44265 0.00005xr99999999 sp3 6s -sp3 8s 4 0.00005 .25895 0.00005 .31205 0.00005xr99999999 sp3 6s -sp3 9s 4 0.00005 .19585 0.00005 .23555 0.00005xr99999999 sp3 6s -sp3 4d 2 -1.62705 -.65685 0.00005 0.00005 0.00005xr99999999 sp3 6s -sp3 5d 2 -1.58235 -.42845 0.00005 0.00005 0.00005xr99999999 sp3 6s -sp3 6d 2 -1.09125 -.28765 0.00005 0.00005 0.00005xr99999999 sp3 6s -sp3 7d 2 -.78845 -.20735 0.00005 0.00005 0.00005xr99999999 sp3 6s -sp3 8d 2 -.59985 -.15795 0.00005 0.00005 0.00005xr99999999 sp3 6s -p5 1 .41585 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 7s -sp3 8s 4 0.00005 .16435 0.00005 .19665 0.00005xr99999999 sp3 7s -sp3 9s 4 0.00005 .12425 0.00005 .14845 0.00005xr99999999 sp3 7s -sp3 4d 2 -.95595 -.41465 0.00005 0.00005 0.00005xr99999999 sp3 7s -sp3 5d 2 -.79075 -.27285 0.00005 0.00005 0.00005xr99999999 sp3 7s -sp3 6d 2 -.65805 -.18405 0.00005 0.00005 0.00005xr99999999 sp3 7s -sp3 7d 2 -.49425 -.13295 0.00005 0.00005 0.00005xr99999999 sp3 7s -sp3 8d 2 -.38305 -.10145 0.00005 0.00005 0.00005xr99999999 sp3 7s -p5 1 .25125 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 8s -sp3 9s 4 0.00005 .08805 0.00005 .10485 0.00005xr99999999 sp3 8s -sp3 4d 2 -.65325 -.29345 0.00005 0.00005 0.00005xr99999999 sp3 8s -sp3 5d 2 -.53575 -.19385 0.00005 0.00005 0.00005xr99999999 sp3 8s -sp3 6d 2 -.41015 -.13095 0.00005 0.00005 0.00005xr99999999 sp3 8s -sp3 7d 2 -.33555 -.09475 0.00005 0.00005 0.00005xr99999999 sp3 8s -sp3 8d 2 -.26505 -.07235 0.00005 0.00005 0.00005xr99999999 sp3 8s -p5 1 .17285 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 9s -sp3 4d 2 -.48435 -.22195 0.00005 0.00005 0.00005xr99999999 sp3 9s -sp3 5d 2 -.39605 -.14695 0.00005 0.00005 0.00005xr99999999 sp3 9s -sp3 6d 2 -.30145 -.09945 0.00005 0.00005 0.00005xr99999999 sp3 9s -sp3 7d 2 -.23495 -.07195 0.00005 0.00005 0.00005xr99999999 sp3 9s -sp3 8d 2 -.19425 -.05495 0.00005 0.00005 0.00005xr99999999 sp3 9s -p5 1 .12855 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 4d -sp3 5d 6 0.00005 1.22765 0.00005 3.58765 2.98935xr99999999 1.76835 sp3 4d -sp3 6d 6 0.00005 .89365 0.00005 2.34425 2.12775xr99999999 1.26255 sp3 4d -sp3 7d 6 0.00005 .67455 0.00005 1.67095 1.58645xr99999999 .94285 sp3 4d -sp3 8d 6 0.00005 .52915 0.00005 1.26585 1.23505xr99999999 .73475 sp3 4d -p5 1 13.49785 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 5d -sp3 6d 6 0.00005 .67905 0.00005 1.78525 1.55235xr99999999 .92825 sp3 5d -sp3 7d 6 0.00005 .51275 0.00005 1.28595 1.15895xr99999999 .69435 sp3 5d -sp3 8d 6 0.00005 .40235 0.00005 .98055 .90295xr99999999 .54155 sp3 5d -p5 1 9.96905 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 6d -sp3 7d 6 0.00005 .37375 0.00005 .93605 .82855xr99999999 .49825 sp3 6d -sp3 8d 6 0.00005 .29325 0.00005 .71645 .64575xr99999999 .38875 sp3 6d -p5 1 7.16745 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 7d -sp3 8d 6 0.00005 .22155 0.00005 .54025 .48265xr99999999 .29115 sp3 7d -p5 1 5.37305 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 8d -p5 1 4.19665 0.00005 0.00005 0.00005 0.00005xr99999999 as i s2p3 as i s2p3 -8.71197( 4p//r2// 4p) 1.000xr 100-100 as i s2p3 as i s2p2 5p 5.80821( 4p//r2// 5p) -.801xr 0 0 as i s2p3 as i s2p2 6p 2.54554( 4p//r2// 6p) -.694xr 0 0 as i s2p3 as i s2p2 7p 1.55670( 4p//r2// 7p) -.641xr 0 0 as i s2p3 as i s2p2 8p 1.08875( 4p//r2// 8p) -.615xr 0 -1 as i s2p3 as i s2p2 9p .82004( 4p//r2// 9p) -.599xr 0 -1 as i s2p3 as i s2p2 4f 2.52858( 4p//r2// 4f) 1.000xr 4-100 as i s2p3 as i s2p2 5f 2.08339( 4p//r2// 5f) 1.000xr 4-100 as i s2p3 as i s2p2 6f 1.67434( 4p//r2// 6f) .999xr 3-100 as i s2p3 as i s2p2 7f 1.36818( 4p//r2// 7f) .998xr 2-100 as i s2p3 as i s2p2 8f 1.14059( 4p//r2// 8f) .997xr 2-100 as i s2p3 as i s2p2 9f .96812( 4p//r2// 9f) .997xr 2-100 as i s2p3 as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p3 as i sp3 4d 2.67964( 4s//r2// 4d) .999xr 24 -98 as i s2p3 as i sp3 5d 1.77298( 4s//r2// 5d) .996xr 17 -98 as i s2p3 as i sp3 6d 1.20540( 4s//r2// 6d) .990xr 12 -98 as i s2p3 as i sp3 7d .87501( 4s//r2// 7d) .983xr 9 -98 as i s2p3 as i sp3 8d .66967( 4s//r2// 8d) .978xr 7 -98 as i s2p3 as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i s2p3 5.80821( 5p//r2// 4p) -.801xr 0 0 as i s2p2 5p as i s2p2 5p -102.10244( 5p//r2// 5p) 1.000xr 100-100 as i s2p2 5p as i s2p2 6p 68.06980( 5p//r2// 6p) -.705xr 0 0 as i s2p2 5p as i s2p2 7p 20.95435( 5p//r2// 7p) -.379xr 0 -1 as i s2p2 5p as i s2p2 8p 11.22766( 5p//r2// 8p) -.289xr 0 -1 as i s2p2 5p as i s2p2 9p 7.38192( 5p//r2// 9p) -.250xr 0 -1 as i s2p2 5p as i s2p2 4f -139.93731( 5p//r2// 4f)-1.000xr -61-100 as i s2p2 5p as i s2p2 5f -49.62246( 5p//r2// 5f) -.659xr -36 -92 as i s2p2 5p as i s2p2 6f -26.26216( 5p//r2// 6f) -.497xr -24 -86 as i s2p2 5p as i s2p2 7f -16.78400( 5p//r2// 7f) -.416xr -18 -83 as i s2p2 5p as i s2p2 8f -11.92904( 5p//r2// 8f) -.369xr -14 -80 as i s2p2 5p as i s2p2 9f -9.06503( 5p//r2// 9f) -.340xr -11 -79 as i s2p2 5p as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5p as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i s2p3 2.54554( 6p//r2// 4p) -.694xr 0 0 as i s2p2 6p as i s2p2 5p 68.06980( 6p//r2// 5p) -.705xr 0 0 as i s2p2 6p as i s2p2 6p -415.42538( 6p//r2// 6p) 1.000xr 100-100 as i s2p2 6p as i s2p2 7p 238.79005( 6p//r2// 7p) -.638xr 0 0 as i s2p2 6p as i s2p2 8p 67.37944( 6p//r2// 8p) -.287xr 0 0 as i s2p2 6p as i s2p2 9p 34.42600( 6p//r2// 9p) -.201xr 0 -1 as i s2p2 6p as i s2p2 4f 473.47010( 6p//r2// 4f) .977xr 79 -84 as i s2p2 6p as i s2p2 5f -321.95239( 6p//r2// 5f) -.744xr -19 -35 as i s2p2 6p as i s2p2 6f -135.04829( 6p//r2// 6f) -.492xr -18 -47 as i s2p2 6p as i s2p2 7f -76.63007( 6p//r2// 7f) -.374xr -14 -49 as i s2p2 6p as i s2p2 8f -50.91917( 6p//r2// 8f) -.313xr -11 -50 as i s2p2 6p as i s2p2 9f -37.11972( 6p//r2// 9f) -.277xr -9 -50 as i s2p2 6p as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6p as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i s2p3 1.55670( 7p//r2// 4p) -.641xr 0 0 as i s2p2 7p as i s2p2 5p 20.95435( 7p//r2// 5p) -.379xr 0 -1 as i s2p2 7p as i s2p2 6p 238.79005( 7p//r2// 6p) -.638xr 0 0 as i s2p2 7p as i s2p2 7p -1149.42639( 7p//r2// 7p) 1.000xr 100-100 as i s2p2 7p as i s2p2 8p 601.37992( 7p//r2// 8p) -.594xr 0 0 as i s2p2 7p as i s2p2 9p 160.98816( 7p//r2// 9p) -.240xr 0 0 as i s2p2 7p as i s2p2 4f -309.57626( 7p//r2// 4f) -.641xr -7 -12 as i s2p2 7p as i s2p2 5f 1434.59457( 7p//r2// 5f) .997xr 90 -93 as i s2p2 7p as i s2p2 6f -610.13007( 7p//r2// 6f) -.537xr -1 -2 as i s2p2 7p as i s2p2 7f -269.85554( 7p//r2// 7f) -.353xr -7 -16 as i s2p2 7p as i s2p2 8f -156.75567( 7p//r2// 8f) -.267xr -7 -21 as i s2p2 7p as i s2p2 9f -105.51925( 7p//r2// 9f) -.221xr -6 -24 as i s2p2 7p as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7p as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i s2p3 1.08875( 8p//r2// 4p) -.615xr 0 -1 as i s2p2 8p as i s2p2 5p 11.22766( 8p//r2// 5p) -.289xr 0 -1 as i s2p2 8p as i s2p2 6p 67.37944( 8p//r2// 6p) -.287xr 0 0 as i s2p2 8p as i s2p2 7p 601.37992( 8p//r2// 7p) -.594xr 0 0 as i s2p2 8p as i s2p2 8p -2570.90271( 8p//r2// 8p) 1.000xr 100-100 as i s2p2 8p as i s2p2 9p 1261.54893( 8p//r2// 9p) -.565xr 0 0 as i s2p2 8p as i s2p2 4f -33.93364( 8p//r2// 4f) -.109xr -1 -3 as i s2p2 8p as i s2p2 5f -989.25217( 8p//r2// 5f) -.676xr -12 -18 as i s2p2 8p as i s2p2 6f 3253.91180( 8p//r2// 6f) .999xr 94 -96 as i s2p2 8p as i s2p2 7f -1038.21059( 8p//r2// 7f) -.414xr 7 -12 as i s2p2 8p as i s2p2 8f -468.53217( 8p//r2// 8f) -.267xr 0 0 as i s2p2 8p as i s2p2 9f -274.23911( 8p//r2// 9f) -.199xr -2 -6 as i s2p2 8p as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8p as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i s2p3 .82004( 9p//r2// 4p) -.599xr 0 -1 as i s2p2 9p as i s2p2 5p 7.38192( 9p//r2// 5p) -.250xr 0 -1 as i s2p2 9p as i s2p2 6p 34.42600( 9p//r2// 6p) -.201xr 0 -1 as i s2p2 9p as i s2p2 7p 160.98816( 9p//r2// 7p) -.240xr 0 0 as i s2p2 9p as i s2p2 8p 1261.54893( 9p//r2// 8p) -.565xr 0 0 as i s2p2 9p as i s2p2 9p -5012.23230( 9p//r2// 9p) 1.000xr 100-100 as i s2p2 9p as i s2p2 4f -13.99470( 9p//r2// 4f) -.062xr 0 -1 as i s2p2 9p as i s2p2 5f -97.78895( 9p//r2// 5f) -.098xr -2 -5 as i s2p2 9p as i s2p2 6f -2321.66862( 9p//r2// 6f) -.701xr -16 -23 as i s2p2 9p as i s2p2 7f 6317.19158( 9p//r2// 7f) .999xr 94 -97 as i s2p2 9p as i s2p2 8f -1643.33274( 9p//r2// 8f) -.337xr 13 -20 as i s2p2 9p as i s2p2 9f -747.17949( 9p//r2// 9f) -.212xr 3 -7 as i s2p2 9p as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9p as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i s2p3 2.52858( 4f//r2// 4p) 1.000xr 4-100 as i s2p2 4f as i s2p2 5p -139.93731( 4f//r2// 5p)-1.000xr -61-100 as i s2p2 4f as i s2p2 6p 473.47010( 4f//r2// 6p) .977xr 79 -84 as i s2p2 4f as i s2p2 7p -309.57626( 4f//r2// 7p) -.641xr -7 -12 as i s2p2 4f as i s2p2 8p -33.93364( 4f//r2// 8p) -.109xr -1 -3 as i s2p2 4f as i s2p2 9p -13.99470( 4f//r2// 9p) -.062xr 0 -1 as i s2p2 4f as i s2p2 4f -489.88733( 4f//r2// 4f) 1.000xr 100-100 as i s2p2 4f as i s2p2 5f 323.00651( 4f//r2// 5f) -.678xr 0 0 as i s2p2 4f as i s2p2 6f 76.53652( 4f//r2// 6f) -.251xr 0 0 as i s2p2 4f as i s2p2 7f 35.49350( 4f//r2// 7f) -.158xr 0 0 as i s2p2 4f as i s2p2 8f 21.37166( 4f//r2// 8f) -.120xr 0 0 as i s2p2 4f as i s2p2 9f 14.72386( 4f//r2// 9f) -.101xr 0 0 as i s2p2 4f as i s2p2 6h 607.65746( 4f//r2// 6h) 1.000xr 44-100 as i s2p2 4f as i s2p2 7h 326.68272( 4f//r2// 7h) .819xr 33 -96 as i s2p2 4f as i s2p2 8h 209.29332( 4f//r2// 8h) .688xr 25 -91 as i s2p2 4f as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4f as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i s2p3 2.08339( 5f//r2// 4p) 1.000xr 4-100 as i s2p2 5f as i s2p2 5p -49.62246( 5f//r2// 5p) -.659xr -36 -92 as i s2p2 5f as i s2p2 6p -321.95239( 5f//r2// 6p) -.744xr -19 -35 as i s2p2 5f as i s2p2 7p 1434.59457( 5f//r2// 7p) .997xr 90 -93 as i s2p2 5f as i s2p2 8p -989.25217( 5f//r2// 8p) -.676xr -12 -18 as i s2p2 5f as i s2p2 9p -97.78895( 5f//r2// 9p) -.098xr -2 -5 as i s2p2 5f as i s2p2 4f 323.00651( 5f//r2// 4f) -.678xr 0 0 as i s2p2 5f as i s2p2 5f -1528.76455( 5f//r2// 5f) 1.000xr 100-100 as i s2p2 5f as i s2p2 6f 871.85859( 5f//r2// 6f) -.625xr 0 0 as i s2p2 5f as i s2p2 7f 209.54277( 5f//r2// 7f) -.223xr 0 0 as i s2p2 5f as i s2p2 8f 97.01687( 5f//r2// 8f) -.136xr 0 0 as i s2p2 5f as i s2p2 9f 58.14847( 5f//r2// 9f) -.101xr 0 0 as i s2p2 5f as i s2p2 6h -2295.33670( 5f//r2// 6h) -.989xr -83 -93 as i s2p2 5f as i s2p2 7h 362.79761( 5f//r2// 7h) .241xr -13 -25 as i s2p2 5f as i s2p2 8h 337.00716( 5f//r2// 8h) .314xr 0 0 as i s2p2 5f as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5f as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i s2p3 1.67434( 6f//r2// 4p) .999xr 3-100 as i s2p2 6f as i s2p2 5p -26.26216( 6f//r2// 5p) -.497xr -24 -86 as i s2p2 6f as i s2p2 6p -135.04829( 6f//r2// 6p) -.492xr -18 -47 as i s2p2 6f as i s2p2 7p -610.13007( 6f//r2// 7p) -.537xr -1 -2 as i s2p2 6f as i s2p2 8p 3253.91180( 6f//r2// 8p) .999xr 94 -96 as i s2p2 6f as i s2p2 9p -2321.66862( 6f//r2// 9p) -.701xr -16 -23 as i s2p2 6f as i s2p2 4f 76.53652( 6f//r2// 4f) -.251xr 0 0 as i s2p2 6f as i s2p2 5f 871.85859( 6f//r2// 5f) -.625xr 0 0 as i s2p2 6f as i s2p2 6f -3545.20112( 6f//r2// 6f) 1.000xr 100-100 as i s2p2 6f as i s2p2 7f 1841.95632( 6f//r2// 7f) -.586xr 0 0 as i s2p2 6f as i s2p2 8f 440.96788( 6f//r2// 8f) -.201xr 0 0 as i s2p2 6f as i s2p2 9f 202.59959( 6f//r2// 9f) -.119xr 0 0 as i s2p2 6f as i s2p2 6h 2445.90779( 6f//r2// 6h) .800xr 34 -44 as i s2p2 6f as i s2p2 7h -4886.72846( 6f//r2// 7h) -.987xr -79 -94 as i s2p2 6f as i s2p2 8h -63.93058( 6f//r2// 8h) -.019xr -29 -50 as i s2p2 6f as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6f as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i s2p3 1.36818( 7f//r2// 4p) .998xr 2-100 as i s2p2 7f as i s2p2 5p -16.78400( 7f//r2// 5p) -.416xr -18 -83 as i s2p2 7f as i s2p2 6p -76.63007( 7f//r2// 6p) -.374xr -14 -49 as i s2p2 7f as i s2p2 7p -269.85554( 7f//r2// 7p) -.353xr -7 -16 as i s2p2 7f as i s2p2 8p -1038.21059( 7f//r2// 8p) -.414xr 7 -12 as i s2p2 7f as i s2p2 9p 6317.19158( 7f//r2// 9p) .999xr 94 -97 as i s2p2 7f as i s2p2 4f 35.49350( 7f//r2// 4f) -.158xr 0 0 as i s2p2 7f as i s2p2 5f 209.54277( 7f//r2// 5f) -.223xr 0 0 as i s2p2 7f as i s2p2 6f 1841.95632( 7f//r2// 6f) -.586xr 0 0 as i s2p2 7f as i s2p2 7f -6988.06696( 7f//r2// 7f) 1.000xr 100-100 as i s2p2 7f as i s2p2 8f 3408.07388( 7f//r2// 8f) -.560xr 0 0 as i s2p2 7f as i s2p2 9f 808.58442( 7f//r2// 9f) -.185xr 0 0 as i s2p2 7f as i s2p2 6h -415.80750( 7f//r2// 6h) -.180xr 3 -5 as i s2p2 7f as i s2p2 7h 6318.62638( 7f//r2// 7h) .893xr 49 -60 as i s2p2 7f as i s2p2 8h -8633.11121( 7f//r2// 8h) -.950xr -70 -88 as i s2p2 7f as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7f as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i s2p3 1.14059( 8f//r2// 4p) .997xr 2-100 as i s2p2 8f as i s2p2 5p -11.92904( 8f//r2// 5p) -.369xr -14 -80 as i s2p2 8f as i s2p2 6p -50.91917( 8f//r2// 6p) -.313xr -11 -50 as i s2p2 8f as i s2p2 7p -156.75567( 8f//r2// 7p) -.267xr -7 -21 as i s2p2 8f as i s2p2 8p -468.53217( 8f//r2// 8p) -.267xr 0 0 as i s2p2 8f as i s2p2 9p -1643.33274( 8f//r2// 9p) -.337xr 13 -20 as i s2p2 8f as i s2p2 4f 21.37166( 8f//r2// 4f) -.120xr 0 0 as i s2p2 8f as i s2p2 5f 97.01687( 8f//r2// 5f) -.136xr 0 0 as i s2p2 8f as i s2p2 6f 440.96788( 8f//r2// 6f) -.201xr 0 0 as i s2p2 8f as i s2p2 7f 3408.07388( 8f//r2// 7f) -.560xr 0 0 as i s2p2 8f as i s2p2 8f -12388.07800( 8f//r2// 8f) 1.000xr 100-100 as i s2p2 8f as i s2p2 9f 5772.22320( 8f//r2// 9f) -.540xr 0 0 as i s2p2 8f as i s2p2 6h -97.47039( 8f//r2// 6h) -.058xr 1 -3 as i s2p2 8f as i s2p2 7h -1208.75722( 8f//r2// 7h) -.217xr 4 -8 as i s2p2 8f as i s2p2 8h 12689.51344( 8f//r2// 8h) .936xr 60 -71 as i s2p2 8f as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8f as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i s2p3 .96812( 9f//r2// 4p) .997xr 2-100 as i s2p2 9f as i s2p2 5p -9.06503( 9f//r2// 5p) -.340xr -11 -79 as i s2p2 9f as i s2p2 6p -37.11972( 9f//r2// 6p) -.277xr -9 -50 as i s2p2 9f as i s2p2 7p -105.51925( 9f//r2// 7p) -.221xr -6 -24 as i s2p2 9f as i s2p2 8p -274.23911( 9f//r2// 8p) -.199xr -2 -6 as i s2p2 9f as i s2p2 9p -747.17949( 9f//r2// 9p) -.212xr 3 -7 as i s2p2 9f as i s2p2 4f 14.72386( 9f//r2// 4f) -.101xr 0 0 as i s2p2 9f as i s2p2 5f 58.14847( 9f//r2// 5f) -.101xr 0 0 as i s2p2 9f as i s2p2 6f 202.59959( 9f//r2// 6f) -.119xr 0 0 as i s2p2 9f as i s2p2 7f 808.58442( 9f//r2// 7f) -.185xr 0 0 as i s2p2 9f as i s2p2 8f 5772.22320( 9f//r2// 8f) -.540xr 0 0 as i s2p2 9f as i s2p2 9f -20357.80485( 9f//r2// 9f) 1.000xr 100-100 as i s2p2 9f as i s2p2 6h -43.66584( 9f//r2// 6h) -.033xr 0 -2 as i s2p2 9f as i s2p2 7h -282.63999( 9f//r2// 7h) -.068xr 2 -5 as i s2p2 9f as i s2p2 8h -2644.41128( 9f//r2// 8h) -.240xr 5 -9 as i s2p2 9f as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9f as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 4f 607.65746( 6h//r2// 4f) 1.000xr 44-100 as i s2p2 6h as i s2p2 5f -2295.33670( 6h//r2// 5f) -.989xr -83 -93 as i s2p2 6h as i s2p2 6f 2445.90779( 6h//r2// 6f) .800xr 34 -44 as i s2p2 6h as i s2p2 7f -415.80750( 6h//r2// 7f) -.180xr 3 -5 as i s2p2 6h as i s2p2 8f -97.47039( 6h//r2// 8f) -.058xr 1 -3 as i s2p2 6h as i s2p2 9f -43.66584( 6h//r2// 9f) -.033xr 0 -2 as i s2p2 6h as i s2p2 6h -2750.91920( 6h//r2// 6h) 1.000xr 100-100 as i s2p2 6h as i s2p2 7h 1514.60172( 6h//r2// 7h) -.596xr 0 0 as i s2p2 6h as i s2p2 8h 301.84338( 6h//r2// 8h) -.171xr 0 0 as i s2p2 6h as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6h as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 4f 326.68272( 7h//r2// 4f) .819xr 33 -96 as i s2p2 7h as i s2p2 5f 362.79761( 7h//r2// 5f) .241xr -13 -25 as i s2p2 7h as i s2p2 6f -4886.72846( 7h//r2// 6f) -.987xr -79 -94 as i s2p2 7h as i s2p2 7f 6318.62638( 7h//r2// 7f) .893xr 49 -60 as i s2p2 7h as i s2p2 8f -1208.75722( 7h//r2// 8f) -.217xr 4 -8 as i s2p2 7h as i s2p2 9f -282.63999( 7h//r2// 9f) -.068xr 2 -5 as i s2p2 7h as i s2p2 6h 1514.60172( 7h//r2// 6h) -.596xr 0 0 as i s2p2 7h as i s2p2 7h -6418.81492( 7h//r2// 7h) 1.000xr 100-100 as i s2p2 7h as i s2p2 8h 3362.77412( 7h//r2// 8h) -.585xr 0 0 as i s2p2 7h as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7h as i p5 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 4f 209.29332( 8h//r2// 4f) .688xr 25 -91 as i s2p2 8h as i s2p2 5f 337.00716( 8h//r2// 5f) .314xr 0 0 as i s2p2 8h as i s2p2 6f -63.93058( 8h//r2// 6f) -.019xr -29 -50 as i s2p2 8h as i s2p2 7f -8633.11121( 8h//r2// 7f) -.950xr -70 -88 as i s2p2 8h as i s2p2 8f 12689.51344( 8h//r2// 8f) .936xr 60 -71 as i s2p2 8h as i s2p2 9f -2644.41128( 8h//r2// 9f) -.240xr 5 -9 as i s2p2 8h as i s2p2 6h 301.84338( 8h//r2// 6h) -.171xr 0 0 as i s2p2 8h as i s2p2 7h 3362.77412( 8h//r2// 7h) -.585xr 0 0 as i s2p2 8h as i s2p2 8h -12414.38166( 8h//r2// 8h) 1.000xr 100-100 as i s2p2 8h as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8h as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i sp3 5s -6.99737( 4p//r2// 4p) 1.000xr 100-100 as i sp3 5s as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5s as i sp3 4d -54.97923( 5s//r2// 4d) -.998xr -87 -97 as i sp3 5s as i sp3 5d 6.87034( 5s//r2// 5d) .228xr -24 -55 as i sp3 5s as i sp3 6d 7.35752( 5s//r2// 6d) .377xr -10 -35 as i sp3 5s as i sp3 7d 5.82615( 5s//r2// 7d) .410xr -5 -24 as i sp3 5s as i sp3 8d 4.61101( 5s//r2// 8d) .419xr -2 -18 as i sp3 5s as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i sp3 6s -6.81142( 4p//r2// 4p) 1.000xr 100-100 as i sp3 6s as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6s as i sp3 4d 106.53475( 6s//r2// 4d) .926xr 41 -55 as i sp3 6s as i sp3 5d -240.92937( 6s//r2// 5d) -.992xr -80 -96 as i sp3 6s as i sp3 6d 8.14224( 6s//r2// 6d) .054xr -29 -58 as i sp3 6s as i sp3 7d 14.75185( 6s//r2// 7d) .145xr -15 -44 as i sp3 6s as i sp3 8d 12.58021( 6s//r2// 8d) .164xr -10 -37 as i sp3 6s as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i sp3 7s -6.77856( 4p//r2// 4p) 1.000xr 100-100 as i sp3 7s as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7s as i sp3 4d -15.71645( 7s//r2// 4d) -.207xr 7 -16 as i sp3 7s as i sp3 5d 399.49733( 7s//r2// 5d) .929xr 50 -64 as i sp3 7s as i sp3 6d -688.22591( 7s//r2// 6d) -.973xr -74 -92 as i sp3 7s as i sp3 7d 1.51438( 7s//r2// 7d) .003xr -29 -54 as i sp3 7s as i sp3 8d 23.60904( 7s//r2// 8d) .071xr -17 -42 as i sp3 7s as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i sp3 8s -6.76810( 4p//r2// 4p) 1.000xr 100-100 as i sp3 8s as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8s as i sp3 4d -6.00058( 8s//r2// 4d) -.124xr 3 -12 as i sp3 8s as i sp3 5d -42.73942( 8s//r2// 5d) -.145xr 10 -21 as i sp3 8s as i sp3 6d 1057.82316( 8s//r2// 6d) .933xr 55 -69 as i sp3 8s as i sp3 7d -1565.56464( 8s//r2// 7d) -.953xr -70 -88 as i sp3 8s as i sp3 8d -20.15731( 8s//r2// 8d) -.018xr -28 -51 as i sp3 8s as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9s as i sp3 9s -6.76369( 4p//r2// 4p) 1.000xr 100-100 as i sp3 9s as i sp3 4d -3.41227( 9s//r2// 4d) -.096xr 2 -10 as i sp3 9s as i sp3 5d -17.18228( 9s//r2// 5d) -.086xr 5 -15 as i sp3 9s as i sp3 6d -97.05227( 9s//r2// 6d) -.120xr 12 -23 as i sp3 9s as i sp3 7d 2305.84049( 9s//r2// 7d) .936xr 59 -73 as i sp3 9s as i sp3 8d -3082.32281( 9s//r2// 8d) -.938xr -67 -85 as i sp3 9s as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p3 2.67964( 4d//r2// 4s) .999xr 24 -98 as i sp3 4d as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4d as i sp3 5s -54.97923( 4d//r2// 5s) -.998xr -87 -97 as i sp3 4d as i sp3 6s 106.53475( 4d//r2// 6s) .926xr 41 -55 as i sp3 4d as i sp3 7s -15.71645( 4d//r2// 7s) -.207xr 7 -16 as i sp3 4d as i sp3 8s -6.00058( 4d//r2// 8s) -.124xr 3 -12 as i sp3 4d as i sp3 9s -3.41227( 4d//r2// 9s) -.096xr 2 -10 as i sp3 4d as i sp3 4d -108.17775( 4d//r2// 4d) 1.000xr 100-100 as i sp3 4d as i sp3 5d 95.44664( 4d//r2// 5d) -.802xr -2 -4 as i sp3 4d as i sp3 6d 21.10219( 4d//r2// 6d) -.298xr -2 -6 as i sp3 4d as i sp3 7d 9.22655( 4d//r2// 7d) -.185xr -1 -7 as i sp3 4d as i sp3 8d 5.30758( 4d//r2// 8d) -.139xr -1 -7 as i sp3 4d as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p3 1.77298( 5d//r2// 4s) .996xr 17 -98 as i sp3 5d as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5d as i sp3 5s 6.87034( 5d//r2// 5s) .228xr -24 -55 as i sp3 5d as i sp3 6s -240.92937( 5d//r2// 6s) -.992xr -80 -96 as i sp3 5d as i sp3 7s 399.49733( 5d//r2// 7s) .929xr 50 -64 as i sp3 5d as i sp3 8s -42.73942( 5d//r2// 8s) -.145xr 10 -21 as i sp3 5d as i sp3 9s -17.18228( 5d//r2// 9s) -.086xr 5 -15 as i sp3 5d as i sp3 4d 95.44664( 5d//r2// 4d) -.802xr -2 -4 as i sp3 5d as i sp3 5d -458.77667( 5d//r2// 5d) 1.000xr 100-100 as i sp3 5d as i sp3 6d 304.25557( 5d//r2// 6d) -.696xr -2 -3 as i sp3 5d as i sp3 7d 74.08771( 5d//r2// 7d) -.266xr -1 -4 as i sp3 5d as i sp3 8d 34.41525( 5d//r2// 8d) -.168xr -1 -4 as i sp3 5d as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p3 1.20540( 6d//r2// 4s) .990xr 12 -98 as i sp3 6d as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6d as i sp3 5s 7.35752( 6d//r2// 5s) .377xr -10 -35 as i sp3 6d as i sp3 6s 8.14224( 6d//r2// 6s) .054xr -29 -58 as i sp3 6d as i sp3 7s -688.22591( 6d//r2// 7s) -.973xr -74 -92 as i sp3 6d as i sp3 8s 1057.82316( 6d//r2// 8s) .933xr 55 -69 as i sp3 6d as i sp3 9s -97.05227( 6d//r2// 9s) -.120xr 12 -23 as i sp3 6d as i sp3 4d 21.10219( 6d//r2// 4d) -.298xr -2 -6 as i sp3 6d as i sp3 5d 304.25557( 6d//r2// 5d) -.696xr -2 -3 as i sp3 6d as i sp3 6d -1284.62340( 6d//r2// 6d) 1.000xr 100-100 as i sp3 6d as i sp3 7d 729.74558( 6d//r2// 7d) -.629xr -1 -2 as i sp3 6d as i sp3 8d 180.20236( 6d//r2// 8d) -.232xr -1 -2 as i sp3 6d as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p3 .87501( 7d//r2// 4s) .983xr 9 -98 as i sp3 7d as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7d as i sp3 5s 5.82615( 7d//r2// 5s) .410xr -5 -24 as i sp3 7d as i sp3 6s 14.75185( 7d//r2// 6s) .145xr -15 -44 as i sp3 7d as i sp3 7s 1.51438( 7d//r2// 7s) .003xr -29 -54 as i sp3 7d as i sp3 8s -1565.56464( 7d//r2// 8s) -.953xr -70 -88 as i sp3 7d as i sp3 9s 2305.84049( 7d//r2// 9s) .936xr 59 -73 as i sp3 7d as i sp3 4d 9.22655( 7d//r2// 4d) -.185xr -1 -7 as i sp3 7d as i sp3 5d 74.08771( 7d//r2// 5d) -.266xr -1 -4 as i sp3 7d as i sp3 6d 729.74558( 7d//r2// 6d) -.629xr -1 -2 as i sp3 7d as i sp3 7d -2883.95487( 7d//r2// 7d) 1.000xr 100-100 as i sp3 7d as i sp3 8d 1491.19418( 7d//r2// 8d) -.588xr -1 -1 as i sp3 7d as i p5 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p3 .66967( 8d//r2// 4s) .978xr 7 -98 as i sp3 8d as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8d as i sp3 5s 4.61101( 8d//r2// 5s) .419xr -2 -18 as i sp3 8d as i sp3 6s 12.58021( 8d//r2// 6s) .164xr -10 -37 as i sp3 8d as i sp3 7s 23.60904( 8d//r2// 7s) .071xr -17 -42 as i sp3 8d as i sp3 8s -20.15731( 8d//r2// 8s) -.018xr -28 -51 as i sp3 8d as i sp3 9s -3082.32281( 8d//r2// 9s) -.938xr -67 -85 as i sp3 8d as i sp3 4d 5.30758( 8d//r2// 4d) -.139xr -1 -7 as i sp3 8d as i sp3 5d 34.41525( 8d//r2// 5d) -.168xr -1 -4 as i sp3 8d as i sp3 6d 180.20236( 8d//r2// 6d) -.232xr -1 -2 as i sp3 8d as i sp3 7d 1491.19418( 8d//r2// 7d) -.588xr -1 -1 as i sp3 8d as i sp3 8d -5627.07327( 8d//r2// 8d) 1.000xr 100-100 as i sp3 8d as i p5 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p3 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 5p 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 6p 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 7p 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 8p 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 9p 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 4f 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 5f 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 6f 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 7f 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 8f 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 9f 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 6h 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 7h 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i s2p2 8h 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 5s 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 6s 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 7s 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 8s 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 9s 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 4d 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 5d 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 6d 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 7d 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i sp3 8d 0.00000( //r2// ) 0.000xr 0 0 as i p5 as i p5 -7.73667( 4p//r2// 4p) 1.000xr 100-100 as i s2p2 5s 4 45.35070 42.96901 1.72392 2.95034 0.00000xr99999999 as i s2p2 6s 4 61.77440 43.64401 1.76172 .71144 0.00000xr99999999 as i s2p2 7s 4 67.04880 43.76581 1.76942 .28454 0.00000xr99999999 as i s2p2 8s 4 69.46710 43.80381 1.77182 .14254 0.00000xr99999999 as i s2p2 9s 4 70.77990 43.81961 1.77292 .08154 0.00000xr99999999 as i s2p2 4d 7 59.29240 43.45911 1.75312 .00522 5.61793xr99999999 3.56294 2.08754 as i s2p2 5d 7 65.94020 43.65991 1.76342 .00332 2.48293xr99999999 1.93694 1.15114 as i s2p2 6d 7 68.89610 43.75231 1.76872 .00182 1.22983xr99999999 1.02464 .61324 as i s2p2 7d 7 70.44990 43.79201 1.77122 .00112 .68313xr99999999 .58604 .35214 as i s2p2 8d 7 71.36560 43.81111 1.77242 .00072 .41513xr99999999 .36174 .21784 as i s2p2 9d 7 71.94960 43.82141 1.77312 .00052 .27013xr99999999 .23754 .14334 as i s2p2 5g 7 69.38630 43.84041 1.77432 .00002 .12503xr99999999 .00014 .00014 as i s2p2 6g 7 70.72760 43.84041 1.77432 .00002 .07243xr99999999 .00014 .00014 as i s2p2 7g 7 71.53800 43.84041 1.77432 .00002 .04563xr99999999 .00014 .00014 as i sp4 4 81.11360 40.38281 1.54302 55.80624 0.00000xr99999999 as i sp3 5p 9 136.41540 44.41061 1.84262 .11582 4.89553xr99999999 60.73664 2.45524 1.82214 1.64774 as i sp3 6p 9 145.99590 44.60061 1.85522 .04322 1.61183xr99999999 60.94664 .85504 .61244 .57374 as i sp3 7p 9 149.63560 44.65631 1.85902 .02082 .73383xr99999999 61.00864 .39984 .28214 .26854 as i sp3 8p 9 151.44310 44.67821 1.86052 .01162 .39643xr99999999 61.03324 .21924 .15344 .14734 as i sp3 9p 9 152.47640 44.68861 1.86122 .00712 .23853xr99999999 61.04504 .13314 .09274 .08954 as i sp3 4f 9 148.11510 44.70101 1.86222 .00002 .51263xr99999999 61.05964 .00364 .01704 .01094 as i sp3 5f 9 150.61490 44.70161 1.86222 .00002 .26853xr99999999 61.06014 .00344 .01504 .00974 as i sp3 6f 9 151.97910 44.70241 1.86222 .00002 .15833xr99999999 61.06094 .00264 .01124 .00724 as i sp3 7f 9 152.80160 44.70311 1.86232 .00002 .10123xr99999999 61.06154 .00204 .00824 .00534 s2p2 5s -s2p2 6s 2 0.00005 1.42645 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 7s 2 0.00005 .89395 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 8s 2 0.00005 .62965 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 9s 2 0.00005 .47495 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 4d 2 -5.36265 -1.30655 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 5d 2 -3.06655 -.84555 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 6d 2 -1.94995 -.57165 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 7d 2 -1.36045 -.41415 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 8d 2 -1.01385 -.31665 0.00005 0.00005 0.00005xr99999999 s2p2 5s -s2p2 9d 2 -.79195 -.25185 0.00005 0.00005 0.00005xr99999999 s2p2 5s -sp4 1 .58695 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 5s -sp3 5p 2 10.33225 1.23045 0.00005 0.00005 0.00005xr99999999 s2p2 5s -sp3 6p 2 5.15245 .77905 0.00005 0.00005 0.00005xr99999999 s2p2 5s -sp3 7p 2 3.34515 .54655 0.00005 0.00005 0.00005xr99999999 s2p2 5s -sp3 8p 2 2.41515 .40985 0.00005 0.00005 0.00005xr99999999 s2p2 5s -sp3 9p 2 1.85445 .32165 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 7s 2 0.00005 .44945 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 8s 2 0.00005 .31775 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 9s 2 0.00005 .24015 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 4d 2 -1.54765 -.63995 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 5d 2 -1.53805 -.42655 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 6d 2 -1.08245 -.29275 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 7d 2 -.79235 -.21385 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 8d 2 -.60775 -.16435 0.00005 0.00005 0.00005xr99999999 s2p2 6s -s2p2 9d 2 -.48395 -.13125 0.00005 0.00005 0.00005xr99999999 s2p2 6s -sp4 1 .29765 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 6s -sp3 5p 2 1.58235 .59785 0.00005 0.00005 0.00005xr99999999 s2p2 6s -sp3 6p 2 3.11705 .38065 0.00005 0.00005 0.00005xr99999999 s2p2 6s -sp3 7p 2 1.98305 .26765 0.00005 0.00005 0.00005xr99999999 s2p2 6s -sp3 8p 2 1.42955 .20095 0.00005 0.00005 0.00005xr99999999 s2p2 6s -sp3 9p 2 1.09835 .15785 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 8s 2 0.00005 .20135 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 9s 2 0.00005 .15225 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 4d 2 -.91095 -.40575 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 5d 2 -.76535 -.27275 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 6d 2 -.65005 -.18795 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 7d 2 -.49505 -.13775 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 8d 2 -.38695 -.10605 0.00005 0.00005 0.00005xr99999999 s2p2 7s -s2p2 9d 2 -.31165 -.08475 0.00005 0.00005 0.00005xr99999999 s2p2 7s -sp4 1 .18045 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 7s -sp3 5p 2 .87975 .37265 0.00005 0.00005 0.00005xr99999999 s2p2 7s -sp3 6p 2 .83075 .23775 0.00005 0.00005 0.00005xr99999999 s2p2 7s -sp3 7p 2 1.31735 .16735 0.00005 0.00005 0.00005xr99999999 s2p2 7s -sp3 8p 2 .94265 .12565 0.00005 0.00005 0.00005xr99999999 s2p2 7s -sp3 9p 2 .72515 .09875 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 9s 2 0.00005 .10775 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 4d 2 -.62265 -.28765 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 5d 2 -.51895 -.19415 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 6d 2 -.40435 -.13405 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 7d 2 -.33525 -.09835 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 8d 2 -.26715 -.07575 0.00005 0.00005 0.00005xr99999999 s2p2 8s -s2p2 9d 2 -.21725 -.06055 0.00005 0.00005 0.00005xr99999999 s2p2 8s -sp4 1 .12415 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 8s -sp3 5p 2 .58225 .26155 0.00005 0.00005 0.00005xr99999999 s2p2 8s -sp3 6p 2 .53365 .16705 0.00005 0.00005 0.00005xr99999999 s2p2 8s -sp3 7p 2 .47365 .11765 0.00005 0.00005 0.00005xr99999999 s2p2 8s -sp3 8p 2 .67345 .08835 0.00005 0.00005 0.00005xr99999999 s2p2 8s -sp3 9p 2 .51645 .06945 0.00005 0.00005 0.00005xr99999999 s2p2 9s -s2p2 4d 2 -.46175 -.21775 0.00005 0.00005 0.00005xr99999999 s2p2 9s -s2p2 5d 2 -.38365 -.14725 0.00005 0.00005 0.00005xr99999999 s2p2 9s -s2p2 6d 2 -.29735 -.10185 0.00005 0.00005 0.00005xr99999999 s2p2 9s -s2p2 7d 2 -.23455 -.07475 0.00005 0.00005 0.00005xr99999999 s2p2 9s -s2p2 8d 2 -.19555 -.05755 0.00005 0.00005 0.00005xr99999999 s2p2 9s -s2p2 9d 2 -.16065 -.04605 0.00005 0.00005 0.00005xr99999999 s2p2 9s -sp4 1 .09235 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 9s -sp3 5p 2 .42325 .19695 0.00005 0.00005 0.00005xr99999999 s2p2 9s -sp3 6p 2 .38225 .12585 0.00005 0.00005 0.00005xr99999999 s2p2 9s -sp3 7p 2 .33165 .08865 0.00005 0.00005 0.00005xr99999999 s2p2 9s -sp3 8p 2 .29235 .06665 0.00005 0.00005 0.00005xr99999999 s2p2 9s -sp3 9p 2 .38885 .05235 0.00005 0.00005 0.00005xr99999999 s2p2 4d -s2p2 5d 4 0.00005 3.26825 2.61915 1.54505 0.00005xr99999999 s2p2 4d -s2p2 6d 4 0.00005 2.16555 1.89875 1.12345 0.00005xr99999999 s2p2 4d -s2p2 7d 4 0.00005 1.55805 1.43275 .84905 0.00005xr99999999 s2p2 4d -s2p2 8d 4 0.00005 1.18705 1.12395 .66665 0.00005xr99999999 s2p2 4d -s2p2 9d 4 0.00005 .94235 .90975 .53995 0.00005xr99999999 s2p2 4d -s2p2 5g 2 -.21525 -.01175 0.00005 0.00005 0.00005xr99999999 s2p2 4d -s2p2 6g 2 -.20565 -.01235 0.00005 0.00005 0.00005xr99999999 s2p2 4d -s2p2 7g 2 -.18055 -.01155 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp4 1 12.36055 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 5p 2 -5.60575 1.87745 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 6p 2 -1.54845 1.05765 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 7p 2 -.91065 .70935 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 8p 2 -.62685 .51995 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 9p 2 -.46785 .40275 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 4f 2 2.72365 .09045 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 5f 2 2.02635 .08755 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 6f 2 1.56285 .07675 0.00005 0.00005 0.00005xr99999999 s2p2 4d -sp3 7f 2 1.25045 .06615 0.00005 0.00005 0.00005xr99999999 s2p2 5d -s2p2 6d 4 0.00005 1.66895 1.40795 .83955 0.00005xr99999999 s2p2 5d -s2p2 7d 4 0.00005 1.21325 1.06395 .63555 0.00005xr99999999 s2p2 5d -s2p2 8d 4 0.00005 .93045 .83525 .49955 0.00005xr99999999 s2p2 5d -s2p2 9d 4 0.00005 .74205 .67655 .40485 0.00005xr99999999 s2p2 5d -s2p2 5g 2 .09085 -.00805 0.00005 0.00005 0.00005xr99999999 s2p2 5d -s2p2 6g 2 .04585 -.00855 0.00005 0.00005 0.00005xr99999999 s2p2 5d -s2p2 7g 2 .02405 -.00795 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp4 1 9.27415 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 5p 2 -1.35985 1.45865 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 6p 2 -2.07195 .82435 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 7p 2 -.84565 .55355 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 8p 2 -.55765 .40595 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 9p 2 -.40975 .31455 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 4f 2 -.35515 .06715 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 5f 2 .53715 .06505 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 6f 2 .56315 .05715 0.00005 0.00005 0.00005xr99999999 s2p2 5d -sp3 7f 2 .50435 .04925 0.00005 0.00005 0.00005xr99999999 s2p2 6d -s2p2 7d 4 0.00005 .89705 .77475 .46455 0.00005xr99999999 s2p2 6d -s2p2 8d 4 0.00005 .69055 .60855 .36535 0.00005xr99999999 s2p2 6d -s2p2 9d 4 0.00005 .55225 .49295 .29615 0.00005xr99999999 s2p2 6d -s2p2 5g 2 .00665 -.00565 0.00005 0.00005 0.00005xr99999999 s2p2 6d -s2p2 6g 2 .03415 -.00605 0.00005 0.00005 0.00005xr99999999 s2p2 6d -s2p2 7g 2 .02925 -.00555 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp4 1 6.79055 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 5p 2 -.39145 1.08615 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 6p 2 -.84775 .61475 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 7p 2 -.97425 .41305 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 8p 2 -.48105 .30295 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 9p 2 -.34035 .23485 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 4f 2 -.05385 .04885 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 5f 2 -.24385 .04745 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 6f 2 .09235 .04165 0.00005 0.00005 0.00005xr99999999 s2p2 6d -sp3 7f 2 .15155 .03595 0.00005 0.00005 0.00005xr99999999 s2p2 7d -s2p2 8d 4 0.00005 .52615 .46035 .27695 0.00005xr99999999 s2p2 7d -s2p2 9d 4 0.00005 .42145 .37305 .22455 0.00005xr99999999 s2p2 7d -s2p2 5g 2 .00575 -.00425 0.00005 0.00005 0.00005xr99999999 s2p2 7d -s2p2 6g 2 .00565 -.00445 0.00005 0.00005 0.00005xr99999999 s2p2 7d -s2p2 7g 2 .01505 -.00415 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp4 1 5.15185 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 5p 2 -.08355 .83175 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 6p 2 -.44885 .47115 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 7p 2 -.50225 .31665 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 8p 2 -.53155 .23235 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 9p 2 -.29535 .18005 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 4f 2 -.03085 .03695 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 5f 2 -.05405 .03585 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 6f 2 -.15825 .03145 0.00005 0.00005 0.00005xr99999999 s2p2 7d -sp3 7f 2 -.00845 .02715 0.00005 0.00005 0.00005xr99999999 s2p2 8d -s2p2 9d 4 0.00005 .33245 .29305 .17675 0.00005xr99999999 s2p2 8d -s2p2 5g 2 .00445 -.00325 0.00005 0.00005 0.00005xr99999999 s2p2 8d -s2p2 6g 2 .00505 -.00345 0.00005 0.00005 0.00005xr99999999 s2p2 8d -s2p2 7g 2 .00435 -.00325 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp4 1 4.05455 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 5p 2 .03005 .65825 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 6p 2 -.27095 .37305 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 7p 2 -.31775 .25085 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 8p 2 -.31405 .18405 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 9p 2 -.32085 .14265 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 4f 2 -.02355 .02905 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 5f 2 -.03205 .02815 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 6f 2 -.04515 .02475 0.00005 0.00005 0.00005xr99999999 s2p2 8d -sp3 7f 2 -.10525 .02135 0.00005 0.00005 0.00005xr99999999 s2p2 9d -s2p2 5g 2 .00355 -.00265 0.00005 0.00005 0.00005xr99999999 s2p2 9d -s2p2 6g 2 .00405 -.00285 0.00005 0.00005 0.00005xr99999999 s2p2 9d -s2p2 7g 2 .00395 -.00265 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp4 1 3.28915 0.00005 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 5p 2 .07415 .53605 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 6p 2 -.17845 .30395 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 7p 2 -.22135 .20435 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 8p 2 -.21845 .14995 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 9p 2 -.20735 .11625 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 4f 2 -.01965 .02355 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 5f 2 -.02375 .02285 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 6f 2 -.02845 .02005 0.00005 0.00005 0.00005xr99999999 s2p2 9d -sp3 7f 2 -.03595 .01735 0.00005 0.00005 0.00005xr99999999 s2p2 5g -s2p2 6g 4 0.00005 .07255 .00015 .00015 0.00005xr99999999 s2p2 5g -s2p2 7g 4 0.00005 .05135 .00015 .00015 0.00005xr99999999 s2p2 5g -sp3 4f 2 -.98655 -.00055 0.00005 0.00005 0.00005xr99999999 s2p2 5g -sp3 5f 2 .00295 -.00055 0.00005 0.00005 0.00005xr99999999 s2p2 5g -sp3 6f 2 -.03175 -.00045 0.00005 0.00005 0.00005xr99999999 s2p2 5g -sp3 7f 2 -.02565 -.00035 0.00005 0.00005 0.00005xr99999999 s2p2 6g -s2p2 7g 4 0.00005 .05095 .00015 .00015 0.00005xr99999999 s2p2 6g -sp3 4f 2 -.69755 -.00055 0.00005 0.00005 0.00005xr99999999 s2p2 6g -sp3 5f 2 -.36875 -.00055 0.00005 0.00005 0.00005xr99999999 s2p2 6g -sp3 6f 2 .00315 -.00045 0.00005 0.00005 0.00005xr99999999 s2p2 6g -sp3 7f 2 -.02385 -.00045 0.00005 0.00005 0.00005xr99999999 s2p2 7g -sp3 4f 2 -.52735 -.00055 0.00005 0.00005 0.00005xr99999999 s2p2 7g -sp3 5f 2 -.33005 -.00055 0.00005 0.00005 0.00005xr99999999 s2p2 7g -sp3 6f 2 -.16535 -.00045 0.00005 0.00005 0.00005xr99999999 s2p2 7g -sp3 7f 2 .00275 -.00035 0.00005 0.00005 0.00005xr99999999 sp4 -sp3 5p 4 1.85285 10.99505 1.33945 5.85745 0.00005xr99999999 sp4 -sp3 6p 4 1.08005 6.39865 .75885 3.27195 0.00005xr99999999 sp4 -sp3 7p 4 .73465 4.34955 .50965 2.18575 0.00005xr99999999 sp4 -sp3 8p 4 .54235 3.21025 .37365 1.59835 0.00005xr99999999 sp4 -sp3 9p 4 .42195 2.49695 .28945 1.23635 0.00005xr99999999 sp4 -sp3 4f 1 .66465 0.00005 0.00005 0.00005 0.00005xr99999999 sp4 -sp3 5f 1 .63535 0.00005 0.00005 0.00005 0.00005xr99999999 sp4 -sp3 6f 1 .55345 0.00005 0.00005 0.00005 0.00005xr99999999 sp4 -sp3 7f 1 .47545 0.00005 0.00005 0.00005 0.00005xr99999999 sp3 5p -sp3 6p 6 0.00005 1.44785 0.00005 2.36245 1.05495xr99999999 .96955 sp3 5p -sp3 7p 6 0.00005 .98945 0.00005 1.52305 .71505xr99999999 .66145 sp3 5p -sp3 8p 6 0.00005 .73225 0.00005 1.09585 .52685xr99999999 .48895 sp3 5p -sp3 9p 6 0.00005 .57045 0.00005 .83985 .40945xr99999999 .38065 sp3 5p -sp3 4f 2 -.89725 .02055 0.00005 0.00005 0.00005xr99999999 sp3 5p -sp3 5f 2 -.71025 .02275 0.00005 0.00005 0.00005xr99999999 sp3 5p -sp3 6f 2 -.55965 .02125 0.00005 0.00005 0.00005xr99999999 sp3 5p -sp3 7f 2 -.45195 .01895 0.00005 0.00005 0.00005xr99999999 sp3 6p -sp3 7p 6 0.00005 .58465 0.00005 1.01475 .41555xr99999999 .39235 sp3 6p -sp3 8p 6 0.00005 .43285 0.00005 .72795 .30635xr99999999 .29045 sp3 6p -sp3 9p 6 0.00005 .33725 0.00005 .55745 .23815xr99999999 .22625 sp3 6p -sp3 4f 2 -.06425 .00745 0.00005 0.00005 0.00005xr99999999 sp3 6p -sp3 5f 2 -.18745 .00885 0.00005 0.00005 0.00005xr99999999 sp3 6p -sp3 6f 2 -.18395 .00855 0.00005 0.00005 0.00005xr99999999 sp3 6p -sp3 7f 2 -.16305 .00775 0.00005 0.00005 0.00005xr99999999 sp3 7p -sp3 8p 6 0.00005 .29605 0.00005 .52085 .20805xr99999999 .19885 sp3 7p -sp3 9p 6 0.00005 .23075 0.00005 .39835 .16175xr99999999 .15495 sp3 7p -sp3 4f 2 -.06455 .00385 0.00005 0.00005 0.00005xr99999999 sp3 7p -sp3 5f 2 -.05065 .00485 0.00005 0.00005 0.00005xr99999999 sp3 7p -sp3 6f 2 -.07305 .00475 0.00005 0.00005 0.00005xr99999999 sp3 7p -sp3 7f 2 -.07265 .00445 0.00005 0.00005 0.00005xr99999999 sp3 8p -sp3 9p 6 0.00005 .17085 0.00005 .30145 .11935xr99999999 .11485 sp3 8p -sp3 4f 2 -.04655 .00235 0.00005 0.00005 0.00005xr99999999 sp3 8p -sp3 5f 2 -.04515 .00315 0.00005 0.00005 0.00005xr99999999 sp3 8p -sp3 6f 2 -.03505 .00315 0.00005 0.00005 0.00005xr99999999 sp3 8p -sp3 7f 2 -.03875 .00295 0.00005 0.00005 0.00005xr99999999 sp3 9p -sp3 4f 2 -.03525 .00165 0.00005 0.00005 0.00005xr99999999 sp3 9p -sp3 5f 2 -.03475 .00225 0.00005 0.00005 0.00005xr99999999 sp3 9p -sp3 6f 2 -.03045 .00225 0.00005 0.00005 0.00005xr99999999 sp3 9p -sp3 7f 2 -.02425 .00215 0.00005 0.00005 0.00005xr99999999 sp3 4f -sp3 5f 6 0.00005 .00355 0.00005 .30195 .01595xr99999999 .01035 sp3 4f -sp3 6f 6 0.00005 .00315 0.00005 .21425 .01385xr99999999 .00895 sp3 4f -sp3 7f 6 0.00005 .00275 0.00005 .16405 .01185xr99999999 .00765 sp3 5f -sp3 6f 6 0.00005 .00305 0.00005 .18995 .01305xr99999999 .00845 sp3 5f -sp3 7f 6 0.00005 .00265 0.00005 .14605 .01115xr99999999 .00715 sp3 6f -sp3 7f 6 0.00005 .00235 0.00005 .12135 .00965xr99999999 .00625 as i s2p2 5s as i s2p2 5s -7.29149( 4p//r2// 4p) 1.000xr 100-100 as i s2p2 5s as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i s2p2 4d -57.92745( 5s//r2// 4d) -.999xr -87 -97 as i s2p2 5s as i s2p2 5d 5.91448( 5s//r2// 5d) .188xr -25 -58 as i s2p2 5s as i s2p2 6d 6.92503( 5s//r2// 6d) .338xr -11 -39 as i s2p2 5s as i s2p2 7d 5.61663( 5s//r2// 7d) .376xr -6 -29 as i s2p2 5s as i s2p2 8d 4.50127( 5s//r2// 8d) .389xr -3 -23 as i s2p2 5s as i s2p2 9d 3.67866( 5s//r2// 9d) .396xr -2 -19 as i s2p2 5s as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5s as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 6s -7.07814( 4p//r2// 4p) 1.000xr 100-100 as i s2p2 6s as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 4d 112.47271( 6s//r2// 4d) .927xr 43 -56 as i s2p2 6s as i s2p2 5d -247.16691( 6s//r2// 5d) -.991xr -78 -95 as i s2p2 6s as i s2p2 6d 4.28623( 6s//r2// 6d) .028xr -29 -59 as i s2p2 6s as i s2p2 7d 13.03697( 6s//r2// 7d) .125xr -16 -45 as i s2p2 6s as i s2p2 8d 11.66040( 6s//r2// 8d) .147xr -10 -38 as i s2p2 6s as i s2p2 9d 9.74605( 6s//r2// 9d) .155xr -7 -34 as i s2p2 6s as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6s as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 7s -7.04185( 4p//r2// 4p) 1.000xr 100-100 as i s2p2 7s as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 4d -17.01399( 7s//r2// 4d) -.211xr 7 -16 as i s2p2 7s as i s2p2 5d 419.72386( 7s//r2// 5d) .934xr 52 -66 as i s2p2 7s as i s2p2 6d -697.03483( 7s//r2// 6d) -.968xr -72 -90 as i s2p2 7s as i s2p2 7d -8.23097( 7s//r2// 7d) -.017xr -29 -55 as i s2p2 7s as i s2p2 8d 19.26236( 7s//r2// 8d) .057xr -17 -43 as i s2p2 7s as i s2p2 9d 19.28685( 7s//r2// 9d) .073xr -11 -37 as i s2p2 7s as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7s as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 8s -7.03065( 4p//r2// 4p) 1.000xr 100-100 as i s2p2 8s as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 4d -6.48451( 8s//r2// 4d) -.126xr 3 -12 as i s2p2 8s as i s2p2 5d -49.54832( 8s//r2// 5d) -.160xr 10 -21 as i s2p2 8s as i s2p2 6d 1103.98327( 8s//r2// 6d) .938xr 57 -71 as i s2p2 8s as i s2p2 7d -1574.67424( 8s//r2// 7d) -.947xr -68 -86 as i s2p2 8s as i s2p2 8d -39.89008( 8s//r2// 8d) -.035xr -28 -51 as i s2p2 8s as i s2p2 9d 24.23883( 8s//r2// 9d) .029xr -17 -40 as i s2p2 8s as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8s as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 9s -7.02600( 4p//r2// 4p) 1.000xr 100-100 as i s2p2 9s as i s2p2 4d -3.68730( 9s//r2// 4d) -.098xr 2 -10 as i s2p2 9s as i s2p2 5d -19.53701( 9s//r2// 5d) -.093xr 5 -15 as i s2p2 9s as i s2p2 6d -114.76245( 9s//r2// 6d) -.136xr 12 -23 as i s2p2 9s as i s2p2 7d 2392.91650( 9s//r2// 7d) .942xr 61 -75 as i s2p2 9s as i s2p2 8d -3087.26629( 9s//r2// 8d) -.930xr -65 -83 as i s2p2 9s as i s2p2 9d -101.36369( 9s//r2// 9d) -.042xr -27 -47 as i s2p2 9s as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9s as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i s2p2 5s -57.92745( 4d//r2// 5s) -.999xr -87 -97 as i s2p2 4d as i s2p2 6s 112.47271( 4d//r2// 6s) .927xr 43 -56 as i s2p2 4d as i s2p2 7s -17.01399( 4d//r2// 7s) -.211xr 7 -16 as i s2p2 4d as i s2p2 8s -6.48451( 4d//r2// 8s) -.126xr 3 -12 as i s2p2 4d as i s2p2 9s -3.68730( 4d//r2// 9s) -.098xr 2 -10 as i s2p2 4d as i s2p2 4d -115.39551( 4d//r2// 4d) 1.000xr 100-100 as i s2p2 4d as i s2p2 5d 98.83642( 4d//r2// 5d) -.791xr -2 -4 as i s2p2 4d as i s2p2 6d 22.51742( 4d//r2// 6d) -.303xr -2 -5 as i s2p2 4d as i s2p2 7d 9.99359( 4d//r2// 7d) -.190xr -1 -6 as i s2p2 4d as i s2p2 8d 5.79112( 4d//r2// 8d) -.144xr -1 -6 as i s2p2 4d as i s2p2 9d 3.86201( 4d//r2// 9d) -.120xr -1 -7 as i s2p2 4d as i s2p2 5g -129.15632( 4d//r2// 5g)-1.000xr -28-100 as i s2p2 4d as i s2p2 6g -80.28865( 4d//r2// 6g) -.922xr -22 -98 as i s2p2 4d as i s2p2 7g -55.85033( 4d//r2// 7g) -.850xr -17 -97 as i s2p2 4d as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 4d as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i s2p2 5s 5.91448( 5d//r2// 5s) .188xr -25 -58 as i s2p2 5d as i s2p2 6s -247.16691( 5d//r2// 6s) -.991xr -78 -95 as i s2p2 5d as i s2p2 7s 419.72386( 5d//r2// 7s) .934xr 52 -66 as i s2p2 5d as i s2p2 8s -49.54832( 5d//r2// 8s) -.160xr 10 -21 as i s2p2 5d as i s2p2 9s -19.53701( 5d//r2// 9s) -.093xr 5 -15 as i s2p2 5d as i s2p2 4d 98.83642( 5d//r2// 4d) -.791xr -2 -4 as i s2p2 5d as i s2p2 5d -480.74422( 5d//r2// 5d) 1.000xr 100-100 as i s2p2 5d as i s2p2 6d 315.29507( 5d//r2// 6d) -.691xr -1 -3 as i s2p2 5d as i s2p2 7d 77.10113( 5d//r2// 7d) -.264xr -1 -3 as i s2p2 5d as i s2p2 8d 35.83664( 5d//r2// 8d) -.167xr -1 -4 as i s2p2 5d as i s2p2 9d 21.45373( 5d//r2// 9d) -.127xr -1 -4 as i s2p2 5d as i s2p2 5g 771.40034( 5d//r2// 5g) .998xr 80 -98 as i s2p2 5d as i s2p2 6g 62.14161( 5d//r2// 6g) .140xr 31 -64 as i s2p2 5d as i s2p2 7g -10.41652( 5d//r2// 7g) -.033xr 16 -47 as i s2p2 5d as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5d as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i s2p2 5s 6.92503( 6d//r2// 5s) .338xr -11 -39 as i s2p2 6d as i s2p2 6s 4.28623( 6d//r2// 6s) .028xr -29 -59 as i s2p2 6d as i s2p2 7s -697.03483( 6d//r2// 7s) -.968xr -72 -90 as i s2p2 6d as i s2p2 8s 1103.98327( 6d//r2// 8s) .938xr 57 -71 as i s2p2 6d as i s2p2 9s -114.76245( 6d//r2// 9s) -.136xr 12 -23 as i s2p2 6d as i s2p2 4d 22.51742( 6d//r2// 4d) -.303xr -2 -5 as i s2p2 6d as i s2p2 5d 315.29507( 6d//r2// 5d) -.691xr -1 -3 as i s2p2 6d as i s2p2 6d -1331.23737( 6d//r2// 6d) 1.000xr 100-100 as i s2p2 6d as i s2p2 7d 753.19094( 6d//r2// 7d) -.627xr -1 -2 as i s2p2 6d as i s2p2 8d 185.80834( 6d//r2// 8d) -.230xr -1 -2 as i s2p2 6d as i s2p2 9d 86.79949( 6d//r2// 9d) -.142xr -1 -2 as i s2p2 6d as i s2p2 5g -1275.33935( 6d//r2// 5g) -.913xr -55 -65 as i s2p2 6d as i s2p2 6g 1621.06854( 6d//r2// 6g) .928xr 57 -82 as i s2p2 6d as i s2p2 7g 355.02637( 6d//r2// 7g) .311xr 33 -68 as i s2p2 6d as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6d as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i s2p2 5s 5.61663( 7d//r2// 5s) .376xr -6 -29 as i s2p2 7d as i s2p2 6s 13.03697( 7d//r2// 6s) .125xr -16 -45 as i s2p2 7d as i s2p2 7s -8.23097( 7d//r2// 7s) -.017xr -29 -55 as i s2p2 7d as i s2p2 8s -1574.67424( 7d//r2// 8s) -.947xr -68 -86 as i s2p2 7d as i s2p2 9s 2392.91650( 7d//r2// 9s) .942xr 61 -75 as i s2p2 7d as i s2p2 4d 9.99359( 7d//r2// 4d) -.190xr -1 -6 as i s2p2 7d as i s2p2 5d 77.10113( 7d//r2// 5d) -.264xr -1 -3 as i s2p2 7d as i s2p2 6d 753.19094( 7d//r2// 6d) -.627xr -1 -2 as i s2p2 7d as i s2p2 7d -2967.41415( 7d//r2// 7d) 1.000xr 100-100 as i s2p2 7d as i s2p2 8d 1532.00789( 7d//r2// 8d) -.587xr -1 -1 as i s2p2 7d as i s2p2 9d 374.83475( 7d//r2// 9d) -.206xr 0 -1 as i s2p2 7d as i s2p2 5g 457.25865( 7d//r2// 5g) .397xr 0 -1 as i s2p2 7d as i s2p2 6g -3493.42954( 7d//r2// 6g) -.975xr -74 -82 as i s2p2 7d as i s2p2 7g 2829.78834( 7d//r2// 7g) .800xr 37 -56 as i s2p2 7d as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7d as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i s2p2 5s 4.50127( 8d//r2// 5s) .389xr -3 -23 as i s2p2 8d as i s2p2 6s 11.66040( 8d//r2// 6s) .147xr -10 -38 as i s2p2 8d as i s2p2 7s 19.26236( 8d//r2// 7s) .057xr -17 -43 as i s2p2 8d as i s2p2 8s -39.89008( 8d//r2// 8s) -.035xr -28 -51 as i s2p2 8d as i s2p2 9s -3087.26629( 8d//r2// 9s) -.930xr -65 -83 as i s2p2 8d as i s2p2 4d 5.79112( 8d//r2// 4d) -.144xr -1 -6 as i s2p2 8d as i s2p2 5d 35.83664( 8d//r2// 5d) -.167xr -1 -4 as i s2p2 8d as i s2p2 6d 185.80834( 8d//r2// 6d) -.230xr -1 -2 as i s2p2 8d as i s2p2 7d 1532.00789( 8d//r2// 7d) -.587xr -1 -1 as i s2p2 8d as i s2p2 8d -5761.86840( 8d//r2// 8d) 1.000xr 100-100 as i s2p2 8d as i s2p2 9d 2796.24767( 8d//r2// 9d) -.559xr 0 -1 as i s2p2 8d as i s2p2 5g 82.41683( 8d//r2// 5g) .103xr 0 -2 as i s2p2 8d as i s2p2 6g 1402.38584( 8d//r2// 6g) .452xr 0 0 as i s2p2 8d as i s2p2 7g -7325.27324( 8d//r2// 7g) -.992xr -84 -90 as i s2p2 8d as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 8d as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i s2p2 5s 3.67866( 9d//r2// 5s) .396xr -2 -19 as i s2p2 9d as i s2p2 6s 9.74605( 9d//r2// 6s) .155xr -7 -34 as i s2p2 9d as i s2p2 7s 19.28685( 9d//r2// 7s) .073xr -11 -37 as i s2p2 9d as i s2p2 8s 24.23883( 9d//r2// 8s) .029xr -17 -40 as i s2p2 9d as i s2p2 9s -101.36369( 9d//r2// 9s) -.042xr -27 -47 as i s2p2 9d as i s2p2 4d 3.86201( 9d//r2// 4d) -.120xr -1 -7 as i s2p2 9d as i s2p2 5d 21.45373( 9d//r2// 5d) -.127xr -1 -4 as i s2p2 9d as i s2p2 6d 86.79949( 9d//r2// 6d) -.142xr -1 -2 as i s2p2 9d as i s2p2 7d 374.83475( 9d//r2// 7d) -.206xr 0 -1 as i s2p2 9d as i s2p2 8d 2796.24767( 9d//r2// 8d) -.559xr 0 -1 as i s2p2 9d as i s2p2 9d -10158.70532( 9d//r2// 9d) 1.000xr 100-100 as i s2p2 9d as i s2p2 5g 35.58233( 9d//r2// 5g) .058xr 0 -1 as i s2p2 9d as i s2p2 6g 236.70431( 9d//r2// 6g) .107xr 0 -1 as i s2p2 9d as i s2p2 7g 3182.20066( 9d//r2// 7g) .489xr 1 -2 as i s2p2 9d as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 9d as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i s2p2 4d -129.15632( 5g//r2// 4d)-1.000xr -28-100 as i s2p2 5g as i s2p2 5d 771.40034( 5g//r2// 5d) .998xr 80 -98 as i s2p2 5g as i s2p2 6d -1275.33935( 5g//r2// 6d) -.913xr -55 -65 as i s2p2 5g as i s2p2 7d 457.25865( 5g//r2// 7d) .397xr 0 -1 as i s2p2 5g as i s2p2 8d 82.41683( 5g//r2// 8d) .103xr 0 -2 as i s2p2 5g as i s2p2 9d 35.58233( 5g//r2// 9d) .058xr 0 -1 as i s2p2 5g as i s2p2 5g -1261.32491( 5g//r2// 5g) 1.000xr 100-100 as i s2p2 5g as i s2p2 6g 752.76304( 5g//r2// 6g) -.632xr 0 0 as i s2p2 5g as i s2p2 7g 162.90154( 5g//r2// 7g) -.204xr 0 0 as i s2p2 5g as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 5g as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i s2p2 4d -80.28865( 6g//r2// 4d) -.922xr -22 -98 as i s2p2 6g as i s2p2 5d 62.14161( 6g//r2// 5d) .140xr 31 -64 as i s2p2 6g as i s2p2 6d 1621.06854( 6g//r2// 6d) .928xr 57 -82 as i s2p2 6g as i s2p2 7d -3493.42954( 6g//r2// 7d) -.975xr -74 -82 as i s2p2 6g as i s2p2 8d 1402.38584( 6g//r2// 8d) .452xr 0 0 as i s2p2 6g as i s2p2 9d 236.70431( 6g//r2// 9d) .107xr 0 -1 as i s2p2 6g as i s2p2 5g 752.76304( 6g//r2// 5g) -.632xr 0 0 as i s2p2 6g as i s2p2 6g -3329.78791( 6g//r2// 6g) 1.000xr 100-100 as i s2p2 6g as i s2p2 7g 1811.47376( 6g//r2// 7g) -.602xr 0 0 as i s2p2 6g as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 6g as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i s2p2 4d -55.85033( 7g//r2// 4d) -.850xr -17 -97 as i s2p2 7g as i s2p2 5d -10.41652( 7g//r2// 5d) -.033xr 16 -47 as i s2p2 7g as i s2p2 6d 355.02637( 7g//r2// 6d) .311xr 33 -68 as i s2p2 7g as i s2p2 7d 2829.78834( 7g//r2// 7d) .800xr 37 -56 as i s2p2 7g as i s2p2 8d -7325.27324( 7g//r2// 8d) -.992xr -84 -90 as i s2p2 7g as i s2p2 9d 3182.20066( 7g//r2// 9d) .489xr 1 -2 as i s2p2 7g as i s2p2 5g 162.90154( 7g//r2// 5g) -.204xr 0 0 as i s2p2 7g as i s2p2 6g 1811.47376( 7g//r2// 6g) -.602xr 0 0 as i s2p2 7g as i s2p2 7g -6966.75249( 7g//r2// 7g) 1.000xr 100-100 as i s2p2 7g as i sp4 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 5p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 6p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 7p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 8p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 9p 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 4f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 5f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 6f 0.00000( //r2// ) 0.000xr 0 0 as i s2p2 7g as i sp3 7f 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp4 as i sp4 -8.18320( 4p//r2// 4p) 1.000xr 100-100 as i sp4 as i sp3 5p 5.16338( 4p//r2// 5p) -.793xr 0 0 as i sp4 as i sp3 6p 2.31984( 4p//r2// 6p) -.700xr 0 -1 as i sp4 as i sp3 7p 1.42865( 4p//r2// 7p) -.653xr 0 -1 as i sp4 as i sp3 8p 1.00188( 4p//r2// 8p) -.628xr 0 -1 as i sp4 as i sp3 9p .75551( 4p//r2// 9p) -.613xr 0 -1 as i sp4 as i sp3 4f 2.09061( 4p//r2// 4f) 1.000xr 4-100 as i sp4 as i sp3 5f 1.75022( 4p//r2// 5f) 1.000xr 3-100 as i sp4 as i sp3 6f 1.41895( 4p//r2// 6f) .999xr 3-100 as i sp4 as i sp3 7f 1.16580( 4p//r2// 7f) .999xr 2-100 as i sp3 5p as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5p as i sp4 5.16338( 5p//r2// 4p) -.793xr 0 0 as i sp3 5p as i sp3 5p -98.15915( 5p//r2// 5p) 1.000xr 100-100 as i sp3 5p as i sp3 6p 65.95538( 5p//r2// 6p) -.709xr 0 0 as i sp3 5p as i sp3 7p 20.31397( 5p//r2// 7p) -.382xr 0 -1 as i sp3 5p as i sp3 8p 10.88486( 5p//r2// 8p) -.292xr 0 -1 as i sp3 5p as i sp3 9p 7.15561( 5p//r2// 9p) -.253xr 0 -1 as i sp3 5p as i sp3 4f -133.50381( 5p//r2// 4f)-1.000xr -59-100 as i sp3 5p as i sp3 5f -49.10742( 5p//r2// 5f) -.680xr -35 -93 as i sp3 5p as i sp3 6f -26.47675( 5p//r2// 6f) -.522xr -24 -87 as i sp3 5p as i sp3 7f -17.11267( 5p//r2// 7f) -.442xr -18 -84 as i sp3 6p as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6p as i sp4 2.31984( 6p//r2// 4p) -.700xr 0 -1 as i sp3 6p as i sp3 5p 65.95538( 6p//r2// 5p) -.709xr 0 0 as i sp3 6p as i sp3 6p -404.05170( 6p//r2// 6p) 1.000xr 100-100 as i sp3 6p as i sp3 7p 233.30122( 6p//r2// 7p) -.639xr 0 0 as i sp3 6p as i sp3 8p 65.84666( 6p//r2// 8p) -.289xr 0 0 as i sp3 6p as i sp3 9p 33.64346( 6p//r2// 9p) -.202xr 0 -1 as i sp3 6p as i sp3 4f 468.31847( 6p//r2// 4f) .979xr 80 -85 as i sp3 6p as i sp3 5f -300.92210( 6p//r2// 5f) -.723xr -17 -31 as i sp3 6p as i sp3 6f -130.87711( 6p//r2// 6f) -.495xr -16 -44 as i sp3 6p as i sp3 7f -75.51012( 6p//r2// 7f) -.382xr -13 -47 as i sp3 7p as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7p as i sp4 1.42865( 7p//r2// 4p) -.653xr 0 -1 as i sp3 7p as i sp3 5p 20.31397( 7p//r2// 5p) -.382xr 0 -1 as i sp3 7p as i sp3 6p 233.30122( 7p//r2// 6p) -.639xr 0 0 as i sp3 7p as i sp3 7p -1124.62344( 7p//r2// 7p) 1.000xr 100-100 as i sp3 7p as i sp3 8p 590.12860( 7p//r2// 8p) -.595xr 0 0 as i sp3 7p as i sp3 9p 158.01873( 7p//r2// 9p) -.241xr 0 0 as i sp3 7p as i sp3 4f -320.18331( 7p//r2// 4f) -.657xr -8 -14 as i sp3 7p as i sp3 5f 1415.84306( 7p//r2// 5f) .997xr 91 -94 as i sp3 7p as i sp3 6f -561.42725( 7p//r2// 6f) -.510xr 0 -1 as i sp3 7p as i sp3 7f -257.96797( 7p//r2// 7f) -.347xr -5 -13 as i sp3 8p as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 8p as i sp4 1.00188( 8p//r2// 4p) -.628xr 0 -1 as i sp3 8p as i sp3 5p 10.88486( 8p//r2// 5p) -.292xr 0 -1 as i sp3 8p as i sp3 6p 65.84666( 8p//r2// 6p) -.289xr 0 0 as i sp3 8p as i sp3 7p 590.12860( 8p//r2// 7p) -.595xr 0 0 as i sp3 8p as i sp3 8p -2524.92178( 8p//r2// 8p) 1.000xr 100-100 as i sp3 8p as i sp3 9p 1241.53635( 8p//r2// 9p) -.566xr 0 0 as i sp3 8p as i sp3 4f -31.48544( 8p//r2// 4f) -.100xr -1 -4 as i sp3 8p as i sp3 5f -1021.70517( 8p//r2// 5f) -.694xr -14 -20 as i sp3 8p as i sp3 6f 3207.19435( 8p//r2// 6f) .999xr 93 -96 as i sp3 8p as i sp3 7f -943.22982( 8p//r2// 7f) -.385xr 10 -16 as i sp3 9p as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 9p as i sp4 .75551( 9p//r2// 4p) -.613xr 0 -1 as i sp3 9p as i sp3 5p 7.15561( 9p//r2// 5p) -.253xr 0 -1 as i sp3 9p as i sp3 6p 33.64346( 9p//r2// 6p) -.202xr 0 -1 as i sp3 9p as i sp3 7p 158.01873( 9p//r2// 7p) -.241xr 0 0 as i sp3 9p as i sp3 8p 1241.53635( 9p//r2// 8p) -.566xr 0 0 as i sp3 9p as i sp3 9p -4935.57544( 9p//r2// 9p) 1.000xr 100-100 as i sp3 9p as i sp3 4f -12.75409( 9p//r2// 4f) -.056xr 0 -2 as i sp3 9p as i sp3 5f -89.35232( 9p//r2// 5f) -.089xr -3 -6 as i sp3 9p as i sp3 6f -2395.43347( 9p//r2// 6f) -.720xr -19 -25 as i sp3 9p as i sp3 7f 6221.21413( 9p//r2// 7f) .998xr 94 -98 as i sp3 4f as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 4f as i sp4 2.09061( 4f//r2// 4p) 1.000xr 4-100 as i sp3 4f as i sp3 5p -133.50381( 4f//r2// 5p)-1.000xr -59-100 as i sp3 4f as i sp3 6p 468.31847( 4f//r2// 6p) .979xr 80 -85 as i sp3 4f as i sp3 7p -320.18331( 4f//r2// 7p) -.657xr -8 -14 as i sp3 4f as i sp3 8p -31.48544( 4f//r2// 8p) -.100xr -1 -4 as i sp3 4f as i sp3 9p -12.75409( 4f//r2// 9p) -.056xr 0 -2 as i sp3 4f as i sp3 4f -489.54616( 4f//r2// 4f) 1.000xr 100-100 as i sp3 4f as i sp3 5f 323.02788( 4f//r2// 5f) -.679xr 0 0 as i sp3 4f as i sp3 6f 76.45692( 4f//r2// 6f) -.251xr 0 0 as i sp3 4f as i sp3 7f 35.42002( 4f//r2// 7f) -.158xr 0 0 as i sp3 5f as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 5f as i sp4 1.75022( 5f//r2// 4p) 1.000xr 3-100 as i sp3 5f as i sp3 5p -49.10742( 5f//r2// 5p) -.680xr -35 -93 as i sp3 5f as i sp3 6p -300.92210( 5f//r2// 6p) -.723xr -17 -31 as i sp3 5f as i sp3 7p 1415.84306( 5f//r2// 7p) .997xr 91 -94 as i sp3 5f as i sp3 8p -1021.70517( 5f//r2// 8p) -.694xr -14 -20 as i sp3 5f as i sp3 9p -89.35232( 5f//r2// 9p) -.089xr -3 -6 as i sp3 5f as i sp3 4f 323.02788( 5f//r2// 4f) -.679xr 0 0 as i sp3 5f as i sp3 5f -1527.36815( 5f//r2// 5f) 1.000xr 100-100 as i sp3 5f as i sp3 6f 871.72220( 5f//r2// 6f) -.626xr 0 0 as i sp3 5f as i sp3 7f 209.34689( 5f//r2// 7f) -.223xr 0 0 as i sp3 6f as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 6f as i sp4 1.41895( 6f//r2// 4p) .999xr 3-100 as i sp3 6f as i sp3 5p -26.47675( 6f//r2// 5p) -.522xr -24 -87 as i sp3 6f as i sp3 6p -130.87711( 6f//r2// 6p) -.495xr -16 -44 as i sp3 6f as i sp3 7p -561.42725( 6f//r2// 7p) -.510xr 0 -1 as i sp3 6f as i sp3 8p 3207.19435( 6f//r2// 8p) .999xr 93 -96 as i sp3 6f as i sp3 9p -2395.43347( 6f//r2// 9p) -.720xr -19 -25 as i sp3 6f as i sp3 4f 76.45692( 6f//r2// 4f) -.251xr 0 0 as i sp3 6f as i sp3 5f 871.72220( 6f//r2// 5f) -.626xr 0 0 as i sp3 6f as i sp3 6f -3541.79625( 6f//r2// 6f) 1.000xr 100-100 as i sp3 6f as i sp3 7f 1841.38775( 6f//r2// 7f) -.587xr 0 0 as i sp3 7f as i s2p2 5s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 6s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 7s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 8s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 9s 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 4d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 5d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 6d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 7d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 8d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 9d 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 5g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 6g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i s2p2 7g 0.00000( //r2// ) 0.000xr 0 0 as i sp3 7f as i sp4 1.16580( 7f//r2// 4p) .999xr 2-100 as i sp3 7f as i sp3 5p -17.11267( 7f//r2// 5p) -.442xr -18 -84 as i sp3 7f as i sp3 6p -75.51012( 7f//r2// 6p) -.382xr -13 -47 as i sp3 7f as i sp3 7p -257.96797( 7f//r2// 7p) -.347xr -5 -13 as i sp3 7f as i sp3 8p -943.22982( 7f//r2// 8p) -.385xr 10 -16 as i sp3 7f as i sp3 9p 6221.21413( 7f//r2// 9p) .998xr 94 -98 as i sp3 7f as i sp3 4f 35.42002( 7f//r2// 4f) -.158xr 0 0 as i sp3 7f as i sp3 5f 209.34689( 7f//r2// 5f) -.223xr 0 0 as i sp3 7f as i sp3 6f 1841.38775( 7f//r2// 6f) -.587xr 0 0 as i sp3 7f as i sp3 7f -6981.43492( 7f//r2// 7f) 1.000xr 100-100 as i s2p3 as i s2p2 5s 1.53205( 4p//r1// 5s) .796xr 23 -48 as i s2p3 as i s2p2 6s .49908( 4p//r1// 6s) .582xr 8 -37 as i s2p3 as i s2p2 7s .27738( 4p//r1// 7s) .518xr 5 -34 as i s2p3 as i s2p2 8s .18484( 4p//r1// 8s) .490xr 3 -32 as i s2p3 as i s2p2 9s .13514( 4p//r1// 9s) .474xr 2 -32 as i s2p3 as i s2p2 4d 2.19926( 4p//r1// 4d) -.999xr -37 -99 as i s2p3 as i s2p2 5d 1.33756( 4p//r1// 5d) -.976xr -25 -99 as i s2p3 as i s2p2 6d .88506( 4p//r1// 6d) -.948xr -17 -98 as i s2p3 as i s2p2 7d .63400( 4p//r1// 7d) -.926xr -13 -97 as i s2p3 as i s2p2 8d .48123( 4p//r1// 8d) -.911xr -10 -96 as i s2p3 as i s2p2 9d .38090( 4p//r1// 9d) -.900xr -8 -96 as i s2p3 as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i s2p3 as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i s2p3 as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i s2p3 as i sp4 2.07702( 4s//r1// 4p)-1.000xr -95-100 as i s2p3 as i sp3 5p .07969( 4s//r1// 5p) -.141xr -13 -57 as i s2p3 as i sp3 6p .03541( 4s//r1// 6p) -.105xr -7 -53 as i s2p3 as i sp3 7p .02138( 4s//r1// 7p) -.092xr -4 -52 as i s2p3 as i sp3 8p .01482( 4s//r1// 8p) -.086xr -3 -51 as i s2p3 as i sp3 9p .01111( 4s//r1// 9p) -.083xr -2 -51 as i s2p3 as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p3 as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p3 as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p3 as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i s2p2 5s -6.71834( 5p//r1// 5s) -.996xr -86 -99 as i s2p2 5p as i s2p2 6s 6.73525( 5p//r1// 6s) .830xr 43 -61 as i s2p2 5p as i s2p2 7s 1.34240( 5p//r1// 7s) .300xr 13 -35 as i s2p2 5p as i s2p2 8s .67961( 5p//r1// 8s) .225xr 7 -29 as i s2p2 5p as i s2p2 9s .43999( 5p//r1// 9s) .197xr 5 -27 as i s2p2 5p as i s2p2 4d -12.46258( 5p//r1// 4d) .988xr 92 -95 as i s2p2 5p as i s2p2 5d 3.81330( 5p//r1// 5d) -.463xr -4 -8 as i s2p2 5p as i s2p2 6d 2.35221( 5p//r1// 6d) -.456xr -7 -23 as i s2p2 5p as i s2p2 7d 1.60508( 5p//r1// 7d) -.429xr -7 -29 as i s2p2 5p as i s2p2 8d 1.18677( 5p//r1// 8d) -.411xr -5 -31 as i s2p2 5p as i s2p2 9d .92611( 5p//r1// 9d) -.399xr -5 -33 as i s2p2 5p as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5p as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i s2p2 5s -.75011( 6p//r1// 5s) -.224xr -24 -57 as i s2p2 6p as i s2p2 6s -13.39050( 6p//r1// 6s) -.971xr -79 -94 as i s2p2 6p as i s2p2 7s 13.84589( 6p//r1// 7s) .843xr 49 -66 as i s2p2 6p as i s2p2 8s 2.42950( 6p//r1// 8s) .241xr 15 -34 as i s2p2 6p as i s2p2 9s 1.18314( 6p//r1// 9s) .166xr 9 -27 as i s2p2 6p as i s2p2 4d 5.46493( 6p//r1// 4d) -.528xr -9 -15 as i s2p2 6p as i s2p2 5d -25.83802( 6p//r1// 5d) .997xr 96 -98 as i s2p2 6p as i s2p2 6d 5.99866( 6p//r1// 6d) -.338xr 1 -2 as i s2p2 6p as i s2p2 7d 3.49406( 6p//r1// 7d) -.300xr -3 -8 as i s2p2 6p as i s2p2 8d 2.36587( 6p//r1// 8d) -.271xr -3 -12 as i s2p2 6p as i s2p2 9d 1.75407( 6p//r1// 9d) -.253xr -3 -14 as i s2p2 6p as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6p as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i s2p2 5s -.30304( 7p//r1// 5s) -.142xr -13 -49 as i s2p2 7p as i s2p2 6s -1.70100( 7p//r1// 6s) -.211xr -24 -51 as i s2p2 7p as i s2p2 7s -22.21085( 7p//r1// 7s) -.950xr -75 -91 as i s2p2 7p as i s2p2 8s 23.11297( 7p//r1// 8s) .849xr 53 -69 as i s2p2 7p as i s2p2 9s 3.79702( 7p//r1// 9s) .211xr 17 -33 as i s2p2 7p as i s2p2 4d 1.42302( 7p//r1// 4d) -.233xr -2 -5 as i s2p2 7p as i s2p2 5d 10.38027( 7p//r1// 5d) -.491xr -9 -13 as i s2p2 7p as i s2p2 6d -43.34551( 7p//r1// 6d) .999xr 97 -99 as i s2p2 7p as i s2p2 7d 8.57703( 7p//r1// 7d) -.279xr 4 -6 as i s2p2 7p as i s2p2 8d 4.76359( 7p//r1// 8d) -.227xr 0 -1 as i s2p2 7p as i s2p2 9d 3.18565( 7p//r1// 9d) -.197xr -1 -5 as i s2p2 7p as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7p as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i s2p2 5s -.17060( 8p//r1// 5s) -.111xr -9 -45 as i s2p2 8p as i s2p2 6s -.70843( 8p//r1// 6s) -.129xr -14 -41 as i s2p2 8p as i s2p2 7s -2.95803( 8p//r1// 7s) -.198xr -24 -46 as i s2p2 8p as i s2p2 8s -33.21967( 8p//r1// 8s) -.935xr -73 -89 as i s2p2 8p as i s2p2 9s 34.57575( 8p//r1// 9s) .853xr 55 -71 as i s2p2 8p as i s2p2 4d .74491( 8p//r1// 4d) -.173xr 0 -3 as i s2p2 8p as i s2p2 5d 2.93745( 8p//r1// 5d) -.218xr -2 -5 as i s2p2 8p as i s2p2 6d 16.50932( 8p//r1// 6d) -.468xr -9 -13 as i s2p2 8p as i s2p2 7d -64.99213( 8p//r1// 7d) 1.000xr 98 -99 as i s2p2 8p as i s2p2 8d 11.54927( 8p//r1// 8d) -.244xr 5 -8 as i s2p2 8p as i s2p2 9d 6.18375( 8p//r1// 9d) -.186xr 0 -1 as i s2p2 8p as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8p as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i s2p2 5s -.11173( 9p//r1// 5s) -.094xr -6 -43 as i s2p2 9p as i s2p2 6s -.40872( 9p//r1// 6s) -.098xr -9 -37 as i s2p2 9p as i s2p2 7s -1.24710( 9p//r1// 7s) -.117xr -14 -36 as i s2p2 9p as i s2p2 8s -4.50746( 9p//r1// 8s) -.186xr -24 -43 as i s2p2 9p as i s2p2 9s -46.42219( 9p//r1// 9s) -.924xr -71 -87 as i s2p2 9p as i s2p2 4d .48769( 9p//r1// 4d) -.149xr 0 -2 as i s2p2 9p as i s2p2 5d 1.55784( 9p//r1// 5d) -.157xr -1 -3 as i s2p2 9p as i s2p2 6d 4.82465( 9p//r1// 6d) -.204xr -2 -5 as i s2p2 9p as i s2p2 7d 24.05700( 9p//r1// 7d) -.455xr -9 -13 as i s2p2 9p as i s2p2 8d -90.78236( 9p//r1// 8d) 1.000xr 98 -99 as i s2p2 9p as i s2p2 9d 14.91716( 9p//r1// 9d) -.221xr 6 -10 as i s2p2 9p as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9p as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i s2p2 4d -14.54501( 4f//r1// 4d)-1.000xr -65-100 as i s2p2 4f as i s2p2 5d 28.62969( 4f//r1// 5d) .949xr 77 -86 as i s2p2 4f as i s2p2 6d -7.77379( 4f//r1// 6d) -.340xr -2 -3 as i s2p2 4f as i s2p2 7d -2.29201( 4f//r1// 7d) -.151xr 0 -1 as i s2p2 4f as i s2p2 8d -1.21096( 4f//r1// 8d) -.107xr 0 0 as i s2p2 4f as i s2p2 9d -.79095( 4f//r1// 9d) -.088xr 0 0 as i s2p2 4f as i s2p2 5g -35.34254( 4f//r1// 5g) 1.000xr 79-100 as i s2p2 4f as i s2p2 6g -10.51675( 4f//r1// 6g) .502xr 36 -73 as i s2p2 4f as i s2p2 7g -5.41495( 4f//r1// 7g) .356xr 22 -62 as i s2p2 4f as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 4f as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i s2p2 4d -5.68520( 5f//r1// 4d) -.689xr -34 -86 as i s2p2 5f as i s2p2 5d -15.55964( 5f//r1// 5d) -.645xr -26 -44 as i s2p2 5f as i s2p2 6d 53.01077( 5f//r1// 6d) .989xr 91 -95 as i s2p2 5f as i s2p2 7d -17.00125( 5f//r1// 7d) -.397xr -5 -8 as i s2p2 5f as i s2p2 8d -4.83345( 5f//r1// 8d) -.165xr -1 -3 as i s2p2 5f as i s2p2 9d -2.51891( 5f//r1// 9d) -.113xr 0 -2 as i s2p2 5f as i s2p2 5g 45.09153( 5f//r1// 5g) -.863xr -60 -70 as i s2p2 5f as i s2p2 6g -44.74480( 5f//r1// 6g) .849xr 54 -77 as i s2p2 5f as i s2p2 7g -15.64507( 5f//r1// 7g) .443xr 30 -62 as i s2p2 5f as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 5f as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i s2p2 4d -3.31320( 6f//r1// 4d) -.565xr -22 -78 as i s2p2 6f as i s2p2 5d -7.37230( 6f//r1// 5d) -.472xr -19 -47 as i s2p2 6f as i s2p2 6d -16.46684( 6f//r1// 6d) -.418xr -8 -13 as i s2p2 6f as i s2p2 7d 81.23650( 6f//r1// 7d) .997xr 95 -97 as i s2p2 6f as i s2p2 8d -28.88583( 6f//r1// 8d) -.435xr -8 -12 as i s2p2 6f as i s2p2 9d -8.00950( 6f//r1// 9d) -.172xr -2 -5 as i s2p2 6f as i s2p2 5g -4.23625( 6f//r1// 5g) .114xr -4 -8 as i s2p2 6f as i s2p2 6g 80.69834( 6f//r1// 6g) -.945xr -75 -84 as i s2p2 6f as i s2p2 7g -55.39002( 6f//r1// 7g) .725xr 40 -59 as i s2p2 6f as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6f as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i s2p2 4d -2.27207( 7f//r1// 4d) -.505xr -16 -74 as i s2p2 7f as i s2p2 5d -4.60598( 7f//r1// 5d) -.392xr -14 -46 as i s2p2 7f as i s2p2 6d -8.47631( 7f//r1// 6d) -.315xr -9 -20 as i s2p2 7f as i s2p2 7d -17.46353( 7f//r1// 7d) -.293xr 0 -1 as i s2p2 7f as i s2p2 8d 113.84552( 7f//r1// 8d) .999xr 97 -98 as i s2p2 7f as i s2p2 9d -43.43518( 7f//r1// 9d) -.461xr -11 -15 as i s2p2 7f as i s2p2 5g -1.34664( 7f//r1// 5g) .051xr -2 -5 as i s2p2 7f as i s2p2 6g -9.01708( 7f//r1// 6g) .141xr -6 -9 as i s2p2 7f as i s2p2 7g 120.95892( 7f//r1// 7g) -.972xr -82 -90 as i s2p2 7f as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7f as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i s2p2 4d -1.69947( 8f//r1// 4d) -.470xr -13 -72 as i s2p2 8f as i s2p2 5d -3.27464( 8f//r1// 5d) -.351xr -11 -45 as i s2p2 8f as i s2p2 6d -5.48268( 8f//r1// 6d) -.264xr -7 -22 as i s2p2 8f as i s2p2 7d -9.43188( 8f//r1// 7d) -.225xr -3 -6 as i s2p2 8f as i s2p2 8d -18.54254( 8f//r1// 8d) -.221xr 6 -8 as i s2p2 8f as i s2p2 9d 151.01546( 8f//r1// 9d) .999xr 97 -99 as i s2p2 8f as i s2p2 5g -.70244( 8f//r1// 5g) .034xr -1 -4 as i s2p2 8f as i s2p2 6g -2.93606( 8f//r1// 6g) .063xr -3 -6 as i s2p2 8f as i s2p2 7g -15.15901( 8f//r1// 7g) .158xr -6 -9 as i s2p2 8f as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8f as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i s2p2 4d -1.34124( 9f//r1// 4d) -.448xr -10 -70 as i s2p2 9f as i s2p2 5d -2.50551( 9f//r1// 5d) -.325xr -9 -45 as i s2p2 9f as i s2p2 6d -3.97537( 9f//r1// 6d) -.236xr -6 -23 as i s2p2 9f as i s2p2 7d -6.22323( 9f//r1// 7d) -.188xr -3 -9 as i s2p2 9f as i s2p2 8d -10.35437( 9f//r1// 8d) -.170xr 0 0 as i s2p2 9f as i s2p2 9d -19.67161( 9f//r1// 9d) -.173xr 9 -13 as i s2p2 9f as i s2p2 5g -.45083( 9f//r1// 5g) .027xr -1 -4 as i s2p2 9f as i s2p2 6g -1.54368( 9f//r1// 6g) .042xr -2 -5 as i s2p2 9f as i s2p2 7g -5.00129( 9f//r1// 7g) .071xr -3 -6 as i s2p2 9f as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 9f as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i s2p2 5g 60.85175( 6h//r1// 5g) 1.000xr 83-100 as i s2p2 6h as i s2p2 6g -66.74791( 6h//r1// 6g) -.823xr -55 -65 as i s2p2 6h as i s2p2 7g 5.31313( 6h//r1// 7g) .090xr -4 -7 as i s2p2 6h as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 6h as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i s2p2 5g 16.67555( 7h//r1// 5g) .442xr 36 -68 as i s2p2 7h as i s2p2 6g 73.92712( 7h//r1// 6g) .876xr 61 -82 as i s2p2 7h as i s2p2 7g -115.02734( 7h//r1// 7g) -.921xr -70 -79 as i s2p2 7h as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 7h as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i s2p2 5g 8.14708( 8h//r1// 5g) .291xr 22 -54 as i s2p2 8h as i s2p2 6g 24.29807( 8h//r1// 6g) .414xr 33 -61 as i s2p2 8h as i s2p2 7g 88.62290( 8h//r1// 7g) .768xr 47 -66 as i s2p2 8h as i sp4 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i s2p2 8h as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i sp4 -1.43140( 5s//r1// 4p) .783xr 22 -46 as i sp3 5s as i sp3 5p 6.56891( 5s//r1// 5p) -.997xr -87 -99 as i sp3 5s as i sp3 6p .73936( 5s//r1// 6p) -.227xr -24 -58 as i sp3 5s as i sp3 7p .29682( 5s//r1// 7p) -.143xr -13 -49 as i sp3 5s as i sp3 8p .16579( 5s//r1// 8p) -.111xr -9 -45 as i sp3 5s as i sp3 9p .10775( 5s//r1// 9p) -.094xr -6 -43 as i sp3 5s as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5s as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i sp4 -.47444( 6s//r1// 4p) .589xr 8 -36 as i sp3 6s as i sp3 5p -6.62739( 6s//r1// 5p) .831xr 43 -61 as i sp3 6s as i sp3 6p 13.19540( 6s//r1// 6p) -.971xr -79 -94 as i sp3 6s as i sp3 7p 1.67617( 6s//r1// 7p) -.211xr -24 -51 as i sp3 6s as i sp3 8p .69529( 6s//r1// 8p) -.129xr -14 -42 as i sp3 6s as i sp3 9p .39953( 6s//r1// 9p) -.098xr -9 -37 as i sp3 6s as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6s as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i sp4 -.26482( 7s//r1// 4p) .529xr 4 -33 as i sp3 7s as i sp3 5p -1.31924( 7s//r1// 5p) .301xr 13 -35 as i sp3 7s as i sp3 6p -13.66019( 7s//r1// 6p) .843xr 49 -66 as i sp3 7s as i sp3 7p 21.99307( 7s//r1// 7p) -.951xr -75 -91 as i sp3 7s as i sp3 8p 2.91118( 7s//r1// 8p) -.197xr -24 -46 as i sp3 7s as i sp3 9p 1.22202( 7s//r1// 9p) -.116xr -14 -36 as i sp3 7s as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7s as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i sp4 -.17689( 8s//r1// 4p) .503xr 3 -32 as i sp3 8s as i sp3 5p -.66899( 8s//r1// 5p) .227xr 7 -29 as i sp3 8s as i sp3 6p -2.40332( 8s//r1// 6p) .242xr 15 -34 as i sp3 8s as i sp3 7p -22.82953( 8s//r1// 7p) .849xr 53 -69 as i sp3 8s as i sp3 8p 32.99748( 8s//r1// 8p) -.936xr -73 -89 as i sp3 8s as i sp3 9p 4.43385( 8s//r1// 9p) -.185xr -24 -43 as i sp3 8s as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8s as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i sp4 -.12952( 9s//r1// 4p) .488xr 2 -31 as i sp3 9s as i sp3 5p -.43362( 9s//r1// 5p) .199xr 5 -27 as i sp3 9s as i sp3 6p -1.17264( 9s//r1// 6p) .168xr 9 -27 as i sp3 9s as i sp3 7p -3.77295( 9s//r1// 7p) .213xr 16 -33 as i sp3 9s as i sp3 8p -34.17842( 9s//r1// 8p) .852xr 55 -71 as i sp3 9s as i sp3 9p 46.21147( 9s//r1// 9p) -.925xr -71 -87 as i sp3 9s as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 9s as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 4d as i sp4 -2.14747( 4d//r1// 4p) -.999xr -38 -99 as i sp3 4d as i sp3 5p 12.10099( 4d//r1// 5p) .987xr 91 -94 as i sp3 4d as i sp3 6p -5.21394( 4d//r1// 6p) -.522xr -8 -14 as i sp3 4d as i sp3 7p -1.36395( 4d//r1// 7p) -.232xr -1 -4 as i sp3 4d as i sp3 8p -.71473( 4d//r1// 8p) -.173xr 0 -2 as i sp3 4d as i sp3 9p -.46825( 4d//r1// 9p) -.149xr 0 -2 as i sp3 4d as i sp3 4f 13.83348( 4d//r1// 4f)-1.000xr -62-100 as i sp3 4d as i sp3 5f 5.61220( 4d//r1// 5f) -.711xr -34 -87 as i sp3 4d as i sp3 6f 3.31913( 4d//r1// 6f) -.591xr -22 -80 as i sp3 4d as i sp3 7f 2.29377( 4d//r1// 7f) -.531xr -16 -76 as i sp3 5d as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 5d as i sp4 -1.30310( 5d//r1// 4p) -.979xr -26 -99 as i sp3 5d as i sp3 5p -4.04813( 5d//r1// 5p) -.497xr -6 -12 as i sp3 5d as i sp3 6p 25.36225( 5d//r1// 6p) .997xr 96 -98 as i sp3 5d as i sp3 7p -9.75607( 5d//r1// 7p) -.476xr -7 -11 as i sp3 5d as i sp3 8p -2.80953( 5d//r1// 8p) -.215xr -1 -4 as i sp3 5d as i sp3 9p -1.49670( 5d//r1// 9p) -.156xr 0 -2 as i sp3 5d as i sp3 4f -28.70858( 5d//r1// 4f) .956xr 80 -87 as i sp3 5d as i sp3 5f 13.84116( 5d//r1// 5f) -.599xr -21 -37 as i sp3 5d as i sp3 6f 6.89475( 5d//r1// 6f) -.459xr -16 -43 as i sp3 5d as i sp3 7f 4.39404( 5d//r1// 7f) -.389xr -13 -43 as i sp3 6d as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 6d as i sp4 -.85154( 6d//r1// 4p) -.951xr -17 -98 as i sp3 6d as i sp3 5p -2.43659( 6d//r1// 5p) -.481xr -9 -27 as i sp3 6d as i sp3 6p -6.46710( 6d//r1// 6p) -.368xr 0 -1 as i sp3 6d as i sp3 7p 42.78681( 6d//r1// 7p) .999xr 97 -99 as i sp3 6d as i sp3 8p -15.50677( 6d//r1// 8p) -.450xr -7 -11 as i sp3 6d as i sp3 9p -4.61981( 6d//r1// 9p) -.200xr -2 -4 as i sp3 6d as i sp3 4f 8.81987( 6d//r1// 4f) -.379xr -4 -6 as i sp3 6d as i sp3 5f -52.75277( 6d//r1// 5f) .991xr 92 -95 as i sp3 6d as i sp3 6f 13.81871( 6d//r1// 6f) -.362xr -3 -6 as i sp3 6d as i sp3 7f 7.57129( 6d//r1// 7f) -.290xr -6 -15 as i sp3 7d as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 7d as i sp4 -.60485( 7d//r1// 4p) -.930xr -13 -97 as i sp3 7d as i sp3 5p -1.64067( 7d//r1// 5p) -.447xr -7 -32 as i sp3 7d as i sp3 6p -3.65053( 7d//r1// 6p) -.317xr -4 -11 as i sp3 7d as i sp3 7p -9.27495( 7d//r1// 7p) -.304xr 2 -3 as i sp3 7d as i sp3 8p 64.36241( 7d//r1// 8p) 1.000xr 98 -99 as i sp3 7d as i sp3 9p -22.68252( 7d//r1// 9p) -.437xr -7 -11 as i sp3 7d as i sp3 4f 2.46186( 7d//r1// 4f) -.160xr -1 -2 as i sp3 7d as i sp3 5f 19.05724( 7d//r1// 5f) -.439xr -8 -12 as i sp3 7d as i sp3 6f -80.45867( 7d//r1// 6f) .997xr 95 -98 as i sp3 7d as i sp3 7f 13.92228( 7d//r1// 7f) -.239xr 4 -7 as i sp3 8d as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i sp3 8d as i sp4 -.45674( 8d//r1// 4p) -.915xr -10 -97 as i sp3 8d as i sp3 5p -1.20351( 8d//r1// 5p) -.425xr -6 -34 as i sp3 8d as i sp3 6p -2.43907( 8d//r1// 6p) -.283xr -4 -15 as i sp3 8d as i sp3 7p -4.99292( 8d//r1// 7p) -.240xr -1 -4 as i sp3 8d as i sp3 8p -12.48338( 8d//r1// 8p) -.266xr 4 -6 as i sp3 8d as i sp3 9p 90.09208( 8d//r1// 9p) 1.000xr 99 -99 as i sp3 8d as i sp3 4f 1.27828( 8d//r1// 4f) -.112xr 0 -1 as i sp3 8d as i sp3 5f 5.12821( 8d//r1// 5f) -.174xr -2 -5 as i sp3 8d as i sp3 6f 32.09217( 8d//r1// 6f) -.479xr -12 -16 as i sp3 8d as i sp3 7f -112.42951( 8d//r1// 7f) .998xr 96 -98 as i p5 as i s2p2 5s 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 6s 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 7s 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 8s 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 9s 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 4d 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 5d 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 6d 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 7d 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 8d 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 9d 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 5g 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 6g 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i s2p2 7g 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp4 -2.02466( 4p//r1// 4s)-1.000xr -95-100 as i p5 as i sp3 5p 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 6p 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 7p 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 8p 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 9p 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 4f 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 5f 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 6f 0.00000( //r1// ) 0.000xr 0 0 as i p5 as i sp3 7f 0.00000( //r1// ) 0.000xr 0 0 -99999999.0