$SETPOOL $SET VERIFY=NOIMAGE $ASSIGN POOLQ:GAq2900O.LIN FOR007 $ASSIGN POOLQ:GAq2900O.WNLIN FOR027 $ASSIGN 2900:GAq2900O.GAM FOR008 $ASSIGN 2900:RRHF2900O.DAT FOR012 $ASSIGN SYS$OUTPUT FOR009 $ASSIGN K4B:C2900O.EIG FOR002 $ASSIGN K4E:C2900O.EIG FOR003 $ASSIGN POOL:GAq290015.DAT FOR015 $ASSIGN 2900:LSq2900O.DAT FOR041 $RUN CRAY:BIGGFQ 29.00 ODD 0. 99999.999 -7.5 62317. 50000. 50000. 1. 99. WAVELO WAVEHI GALO EION EGALO EBOLT STARTJJ STOPJJ 0 $SORT/STAT POOLQ:GAq2900O.LIN POOLQ:GAq2900O.LIN $SORT/STAT POOLQ:GAq2900O.WNLIN POOLQ:GAq2900O.WNLIN 1 29 (d9 4s )d9 4s4p (d9 4s )d9 4s4f 12.06805 1 30 (d9 4s )d9 4s4p (d9 4s )d9 4s5f -20.85578 1 31 (d9 4s )d9 4s4p (d9 4s )d9 4s6f 14.10753 1 32 (d9 4s )d9 4s4p (d9 4s )d9 4s7f -4.49285 1 33 (d9 4s )d9 4s4p (d9 4s )d9 4s8f -0.36157 1 34 (d9 4s )d9 4s4p (d9 4s )d9 4s9f 1.35623 1 35 (d9 4s )d9 4s4p (d9 4s )d9 4s10f -0.95869 1 36 (d9 4s )d9 4s4p (d9 4s )d9 4s11f 0.41695 1 37 (d9 4s )d9 4s4p (d9 4s )d9 4s12f 0.97183 1 38 (d9 4s )d9 4s4p (d9 4s )d9 4s13f 0.75627 1 39 (d9 4s )d9 4s4p (d9 4s )d9 4s14f 0.56968 2 29 (d9 4s )d9 4s5p (d9 4s )d9 4s4f -26.56054 2 30 (d9 4s )d9 4s5p (d9 4s )d9 4s5f 86.30682 2 31 (d9 4s )d9 4s5p (d9 4s )d9 4s6f -119.48752 2 32 (d9 4s )d9 4s5p (d9 4s )d9 4s7f 101.21955 2 33 (d9 4s )d9 4s5p (d9 4s )d9 4s8f -71.51383 2 34 (d9 4s )d9 4s5p (d9 4s )d9 4s9f 46.48630 2 35 (d9 4s )d9 4s5p (d9 4s )d9 4s10f -28.50077 2 36 (d9 4s )d9 4s5p (d9 4s )d9 4s11f 14.03043 2 37 (d9 4s )d9 4s5p (d9 4s )d9 4s12f -7.06192 2 38 (d9 4s )d9 4s5p (d9 4s )d9 4s13f -6.36238 2 39 (d9 4s )d9 4s5p (d9 4s )d9 4s14f -5.77335 3 29 (d9 4s )d9 4s6p (d9 4s )d9 4s4f 28.01740 3 30 (d9 4s )d9 4s6p (d9 4s )d9 4s5f -134.24357 3 31 (d9 4s )d9 4s6p (d9 4s )d9 4s6f 259.25828 3 32 (d9 4s )d9 4s6p (d9 4s )d9 4s7f -296.52523 3 33 (d9 4s )d9 4s6p (d9 4s )d9 4s8f 282.08737 3 34 (d9 4s )d9 4s6p (d9 4s )d9 4s9f -250.13962 3 35 (d9 4s )d9 4s6p (d9 4s )d9 4s10f 213.26257 3 36 (d9 4s )d9 4s6p (d9 4s )d9 4s11f -168.07299 3 37 (d9 4s )d9 4s6p (d9 4s )d9 4s12f -2.10473 3 38 (d9 4s )d9 4s6p (d9 4s )d9 4s13f -0.60690 3 39 (d9 4s )d9 4s6p (d9 4s )d9 4s14f 0.83016 4 29 (d9 4s )d9 4s7p (d9 4s )d9 4s4f -21.68803 4 30 (d9 4s )d9 4s7p (d9 4s )d9 4s5f 140.69499 4 31 (d9 4s )d9 4s7p (d9 4s )d9 4s6f -337.14702 4 32 (d9 4s )d9 4s7p (d9 4s )d9 4s7f 456.87056 4 33 (d9 4s )d9 4s7p (d9 4s )d9 4s8f -501.04087 4 34 (d9 4s )d9 4s7p (d9 4s )d9 4s9f 506.88146 4 35 (d9 4s )d9 4s7p (d9 4s )d9 4s10f -489.47809 4 36 (d9 4s )d9 4s7p (d9 4s )d9 4s11f 449.40216 4 37 (d9 4s )d9 4s7p (d9 4s )d9 4s12f 18.82088 4 38 (d9 4s )d9 4s7p (d9 4s )d9 4s13f 15.65698 4 39 (d9 4s )d9 4s7p (d9 4s )d9 4s14f 12.85669 5 29 (d9 4s )d9 4s8p (d9 4s )d9 4s4f 14.38450 5 30 (d9 4s )d9 4s8p (d9 4s )d9 4s5f -122.98280 5 31 (d9 4s )d9 4s8p (d9 4s )d9 4s6f 346.18715 5 32 (d9 4s )d9 4s8p (d9 4s )d9 4s7f -525.67065 5 33 (d9 4s )d9 4s8p (d9 4s )d9 4s8f 629.31782 5 34 (d9 4s )d9 4s8p (d9 4s )d9 4s9f -687.52226 5 35 (d9 4s )d9 4s8p (d9 4s )d9 4s10f 710.51479 5 36 (d9 4s )d9 4s8p (d9 4s )d9 4s11f -705.75772 5 37 (d9 4s )d9 4s8p (d9 4s )d9 4s12f -20.62563 5 38 (d9 4s )d9 4s8p (d9 4s )d9 4s13f -18.88048 5 39 (d9 4s )d9 4s8p (d9 4s )d9 4s14f -17.53513 6 29 (d9 4s )d9 4s9p (d9 4s )d9 4s4f -8.69922 6 30 (d9 4s )d9 4s9p (d9 4s )d9 4s5f 99.06403 6 31 (d9 4s )d9 4s9p (d9 4s )d9 4s6f -320.15876 6 32 (d9 4s )d9 4s9p (d9 4s )d9 4s7f 531.14555 6 33 (d9 4s )d9 4s9p (d9 4s )d9 4s8f -677.74856 6 34 (d9 4s )d9 4s9p (d9 4s )d9 4s9f 781.28568 6 35 (d9 4s )d9 4s9p (d9 4s )d9 4s10f -845.27777 6 36 (d9 4s )d9 4s9p (d9 4s )d9 4s11f 883.13954 6 37 (d9 4s )d9 4s9p (d9 4s )d9 4s12f 8.22841 6 38 (d9 4s )d9 4s9p (d9 4s )d9 4s13f 9.67020 6 39 (d9 4s )d9 4s9p (d9 4s )d9 4s14f 11.22532 7 29 (d9 4s )d9 4s10p (d9 4s )d9 4s4f 5.86940 7 30 (d9 4s )d9 4s10p (d9 4s )d9 4s5f -81.73706 7 31 (d9 4s )d9 4s10p (d9 4s )d9 4s6f 290.81296 7 32 (d9 4s )d9 4s10p (d9 4s )d9 4s7f -512.54881 7 33 (d9 4s )d9 4s10p (d9 4s )d9 4s8f 682.20657 7 34 (d9 4s )d9 4s10p (d9 4s )d9 4s9f -813.50008 7 35 (d9 4s )d9 4s10p (d9 4s )d9 4s10f 905.84150 7 36 (d9 4s )d9 4s10p (d9 4s )d9 4s11f -978.01138 7 37 (d9 4s )d9 4s10p (d9 4s )d9 4s12f 7.69109 7 38 (d9 4s )d9 4s10p (d9 4s )d9 4s13f 3.29452 7 39 (d9 4s )d9 4s10p (d9 4s )d9 4s14f -0.82212 8 29 (d9 4s )d9 4s11p (d9 4s )d9 4s4f -4.49542 8 30 (d9 4s )d9 4s11p (d9 4s )d9 4s5f 69.28485 8 31 (d9 4s )d9 4s11p (d9 4s )d9 4s6f -263.70367 8 32 (d9 4s )d9 4s11p (d9 4s )d9 4s7f 486.62020 8 33 (d9 4s 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-2.11838 10 32 (d9 4s )d9 4s13p (d9 4s )d9 4s7f 5.01773 10 33 (d9 4s )d9 4s13p (d9 4s )d9 4s8f -6.10746 10 34 (d9 4s )d9 4s13p (d9 4s )d9 4s9f 5.69524 10 35 (d9 4s )d9 4s13p (d9 4s )d9 4s10f -5.19210 10 36 (d9 4s )d9 4s13p (d9 4s )d9 4s11f 7.08936 10 37 (d9 4s )d9 4s13p (d9 4s )d9 4s12f-19501.91216 10 38 (d9 4s )d9 4s13p (d9 4s )d9 4s13f -5390.86673 10 39 (d9 4s )d9 4s13p (d9 4s )d9 4s14f -2571.91292 11 29 (d9 4s )d9 4s14p (d9 4s )d9 4s4f 0.22738 11 30 (d9 4s )d9 4s14p (d9 4s )d9 4s5f -0.38764 11 31 (d9 4s )d9 4s14p (d9 4s )d9 4s6f -1.50288 11 32 (d9 4s )d9 4s14p (d9 4s )d9 4s7f 3.99768 11 33 (d9 4s )d9 4s14p (d9 4s )d9 4s8f -5.12898 11 34 (d9 4s )d9 4s14p (d9 4s )d9 4s9f 5.03390 11 35 (d9 4s )d9 4s14p (d9 4s )d9 4s10f -4.80510 11 36 (d9 4s )d9 4s14p (d9 4s )d9 4s11f 6.68660 11 37 (d9 4s )d9 4s14p (d9 4s )d9 4s12f 68792.75156 11 38 (d9 4s )d9 4s14p (d9 4s )d9 4s13f-26476.41120 11 39 (d9 4s )d9 4s14p (d9 4s )d9 4s14f -7238.01401 12 29 (d9 4s )d9 4s15p (d9 4s )d9 4s4f 0.20067 12 30 (d9 4s )d9 4s15p (d9 4s )d9 4s5f -0.44509 12 31 (d9 4s )d9 4s15p (d9 4s )d9 4s6f -1.01671 12 32 (d9 4s )d9 4s15p (d9 4s )d9 4s7f 3.20352 12 33 (d9 4s )d9 4s15p (d9 4s )d9 4s8f -4.37398 12 34 (d9 4s )d9 4s15p (d9 4s )d9 4s9f 4.51890 12 35 (d9 4s )d9 4s15p (d9 4s )d9 4s10f -4.47177 12 36 (d9 4s )d9 4s15p (d9 4s )d9 4s11f 6.27524 12 37 (d9 4s )d9 4s15p (d9 4s )d9 4s12f-25743.84597 12 38 (d9 4s )d9 4s15p (d9 4s )d9 4s13f 96260.56567 12 39 (d9 4s )d9 4s15p (d9 4s )d9 4s14f-34696.46584 13 40 (d10 )d10 4p (d10 )d10 4f 11.92654 13 41 (d10 )d10 4p (d10 )d10 5f -23.71164 13 42 (d10 )d10 4p (d10 )d10 6f 27.33251 13 43 (d10 )d10 4p (d10 )d10 7f 4.36129 13 44 (d10 )d10 4p (d10 )d10 8f 3.37094 13 45 (d10 )d10 4p (d10 )d10 9f 2.64992 13 46 (d10 )d10 4p (d10 )d10 10f 2.11364 13 47 (d10 )d10 4p (d10 )d10 11f 1.69002 13 48 (d10 )d10 4p (d10 )d10 12f 1.33349 14 40 (d10 )d10 5p (d10 )d10 4f -17.80960 14 41 (d10 )d10 5p (d10 )d10 5f 50.47456 14 42 (d10 )d10 5p (d10 )d10 6f -83.65426 14 43 (d10 )d10 5p (d10 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15p (d10 )d10 11f -3106.45187 24 48 (d10 )d10 15p (d10 )d10 12f -19346.34577 25 49 (d8s2 )d8s2 4p (d8s2 )d8s2 4f 5.66173 26 49 (d8s2 )d8s2 5p (d8s2 )d8s2 4f -149.00829 27 49 (d8s2 )d8s2 6p (d8s2 )d8s2 4f 428.98119 28 49 (d8s2 )d8s2 7p (d8s2 )d8s2 4f -446.45242 29 40 (d9 4f )d9 4s4f (d9 4f )d10 4f -1.56207 29 49 (d8s2 )d8s2 4f (d8s2 )d8s2 4f 471.99930 29 29 (d9 4s )d9 4s4f (d9 4s )d9 4s4f 12.28385 29 30 (d9 4s )d9 4s4f (d9 4s )d9 4s5f -28.00199 29 31 (d9 4s )d9 4s4f (d9 4s )d9 4s6f 34.34882 29 32 (d9 4s )d9 4s4f (d9 4s )d9 4s7f -30.00444 29 33 (d9 4s )d9 4s4f (d9 4s )d9 4s8f 23.93690 29 34 (d9 4s )d9 4s4f (d9 4s )d9 4s9f -18.95689 29 35 (d9 4s )d9 4s4f (d9 4s )d9 4s10f 14.98208 29 36 (d9 4s )d9 4s4f (d9 4s )d9 4s11f -11.03444 29 37 (d9 4s )d9 4s4f (d9 4s )d9 4s12f 1.09593 29 38 (d9 4s )d9 4s4f (d9 4s )d9 4s13f 1.00714 29 39 (d9 4s )d9 4s4f (d9 4s )d9 4s14f 0.93927 29 50 (d9 4s )d9 4s4f (d9 4s )d9 4s6h 10.44411 29 51 (d9 4s )d9 4s4f (d9 4s )d9 4s7h 8.72182 29 52 (d9 4s )d9 4s4f (d9 4s 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(d9 4s )d9 4s6h -1467.11631 36 51 (d9 4s )d9 4s11f (d9 4s )d9 4s7h -403.01693 36 52 (d9 4s )d9 4s11f (d9 4s )d9 4s8h -177.22796 36 53 (d9 4s )d9 4s11f (d9 4s )d9 4s9h -103.49018 37 29 (d9 4s )d9 4s12f (d9 4s )d9 4s4f 1.09593 37 30 (d9 4s )d9 4s12f (d9 4s )d9 4s5f -0.20440 37 31 (d9 4s )d9 4s12f (d9 4s )d9 4s6f -5.50147 37 32 (d9 4s )d9 4s12f (d9 4s )d9 4s7f 8.93825 37 33 (d9 4s )d9 4s12f (d9 4s )d9 4s8f -7.99197 37 34 (d9 4s )d9 4s12f (d9 4s )d9 4s9f 4.57577 37 35 (d9 4s )d9 4s12f (d9 4s )d9 4s10f -1.06419 37 36 (d9 4s )d9 4s12f (d9 4s )d9 4s11f -2.65559 37 37 (d9 4s )d9 4s12f (d9 4s )d9 4s12f 70043.57798 37 38 (d9 4s )d9 4s12f (d9 4s )d9 4s13f-26684.65082 37 39 (d9 4s )d9 4s12f (d9 4s )d9 4s14f -6238.82176 37 50 (d9 4s )d9 4s12f (d9 4s )d9 4s6h -9.32950 37 51 (d9 4s )d9 4s12f (d9 4s )d9 4s7h -39.16738 37 52 (d9 4s )d9 4s12f (d9 4s )d9 4s8h -133.97344 37 53 (d9 4s )d9 4s12f (d9 4s )d9 4s9h -462.61829 38 29 (d9 4s )d9 4s13f (d9 4s )d9 4s4f 1.00714 38 30 (d9 4s )d9 4s13f (d9 4s )d9 4s5f -0.51396 38 31 (d9 4s )d9 4s13f (d9 4s )d9 4s6f -4.39760 38 32 (d9 4s )d9 4s13f (d9 4s )d9 4s7f 7.87505 38 33 (d9 4s )d9 4s13f (d9 4s )d9 4s8f -7.66918 38 34 (d9 4s )d9 4s13f (d9 4s )d9 4s9f 5.26698 38 35 (d9 4s )d9 4s13f (d9 4s )d9 4s10f -2.69689 38 36 (d9 4s )d9 4s13f (d9 4s )d9 4s11f 0.10000 38 37 (d9 4s )d9 4s13f (d9 4s )d9 4s12f-26684.65082 38 38 (d9 4s )d9 4s13f (d9 4s )d9 4s13f 98141.08582 38 39 (d9 4s )d9 4s13f (d9 4s )d9 4s14f-35989.93679 38 50 (d9 4s )d9 4s13f (d9 4s )d9 4s6h -6.01618 38 51 (d9 4s )d9 4s13f (d9 4s )d9 4s7h -24.51039 38 52 (d9 4s )d9 4s13f (d9 4s )d9 4s8h -78.21520 38 53 (d9 4s )d9 4s13f (d9 4s )d9 4s9h -240.55365 39 29 (d9 4s )d9 4s14f (d9 4s )d9 4s4f 0.93927 39 30 (d9 4s )d9 4s14f (d9 4s )d9 4s5f -0.82181 39 31 (d9 4s )d9 4s14f (d9 4s )d9 4s6f -3.41485 39 32 (d9 4s )d9 4s14f (d9 4s )d9 4s7f 6.98817 39 33 (d9 4s )d9 4s14f (d9 4s )d9 4s8f -7.46667 39 34 (d9 4s )d9 4s14f (d9 4s )d9 4s9f 5.94732 39 35 (d9 4s )d9 4s14f (d9 4s )d9 4s10f -4.17108 39 36 (d9 4s )d9 4s14f (d9 4s )d9 4s11f 2.56558 39 37 (d9 4s )d9 4s14f (d9 4s )d9 4s12f -6238.82176 39 38 (d9 4s )d9 4s14f (d9 4s )d9 4s13f-35989.93679 39 39 (d9 4s )d9 4s14f (d9 4s )d9 4s14f134212.44309 39 50 (d9 4s )d9 4s14f (d9 4s )d9 4s6h -3.56864 39 51 (d9 4s )d9 4s14f (d9 4s )d9 4s7h -14.82844 39 52 (d9 4s )d9 4s14f (d9 4s )d9 4s8h -46.29352 39 53 (d9 4s )d9 4s14f (d9 4s )d9 4s9h -135.32950 40 40 (d9 4f )d10 4f (d9 4f )d10 4f 1.25410 40 40 (d10 )d10 4f (d10 )d10 4f 8.60783 40 41 (d10 )d10 4f (d10 )d10 5f -15.34877 40 42 (d10 )d10 4f (d10 )d10 6f 18.19751 40 43 (d10 )d10 4f (d10 )d10 7f 2.76142 40 44 (d10 )d10 4f (d10 )d10 8f 2.08918 40 45 (d10 )d10 4f (d10 )d10 9f 1.65534 40 46 (d10 )d10 4f (d10 )d10 10f 1.36124 40 47 (d10 )d10 4f (d10 )d10 11f 1.14680 40 48 (d10 )d10 4f (d10 )d10 12f 0.97968 40 54 (d10 )d10 4f (d10 )d10 6h 3.04629 40 55 (d10 )d10 4f (d10 )d10 7h 2.76070 40 56 (d10 )d10 4f (d10 )d10 8h 2.23295 40 57 (d10 )d10 4f (d10 )d10 9h 1.78306 41 40 (d10 )d10 5f (d10 )d10 4f -15.34877 41 41 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6f (d10 )d10 9h 24.31095 43 40 (d10 )d10 7f (d10 )d10 4f 2.76142 43 41 (d10 )d10 7f (d10 )d10 5f -6.34331 43 42 (d10 )d10 7f (d10 )d10 6f 7.18780 43 43 (d10 )d10 7f (d10 )d10 7f 7098.04810 43 44 (d10 )d10 7f (d10 )d10 8f -3343.81532 43 45 (d10 )d10 7f (d10 )d10 9f -813.12231 43 46 (d10 )d10 7f (d10 )d10 10f -381.78054 43 47 (d10 )d10 7f (d10 )d10 11f -232.62756 43 48 (d10 )d10 7f (d10 )d10 12f -162.10050 43 54 (d10 )d10 7f (d10 )d10 6h -422.21953 43 55 (d10 )d10 7f (d10 )d10 7h 6524.37666 43 56 (d10 )d10 7f (d10 )d10 8h -8641.56454 43 57 (d10 )d10 7f (d10 )d10 9h -994.01840 44 40 (d10 )d10 8f (d10 )d10 4f 2.08918 44 41 (d10 )d10 8f (d10 )d10 5f -4.78536 44 42 (d10 )d10 8f (d10 )d10 6f 5.51018 44 43 (d10 )d10 8f (d10 )d10 7f -3343.81532 44 44 (d10 )d10 8f (d10 )d10 8f 12662.61795 44 45 (d10 )d10 8f (d10 )d10 9f -5647.12481 44 46 (d10 )d10 8f (d10 )d10 10f -1360.97015 44 47 (d10 )d10 8f (d10 )d10 11f -632.35809 44 48 (d10 )d10 8f (d10 )d10 12f -381.01201 44 54 (d10 )d10 8f (d10 )d10 6h 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