$ Set NoOn $ VERIFY = F$VERIFY(F$TRNLNM("SYLOGIN_VERIFY")) %SET-W-NOTSET, error modifying CFAKU1$DKB0: -SET-E-INVDEV, device is invalid for requested operation $ EXIT $SET def 1504 $SET VERIFY=NOIMAGE $ASSIGN B1504E.PUN FOR007 $ASSIGN H1504E.HAM FOR001 $ASSIGN B1504E.EIG FOR003 $ASSIGN EAV1504E.DAT FOR066 $ASSIGN POOLG:B1504E15 FOR015 $ASSIGN POOLG:B1504E16 FOR016 $RUN CRAY:LEAST3007 NPAR 263 NJ 7 FIRSTJ 0.5 1 p 6 s 1 p 0 s 0 d 0 g 0 i 0 s 0 2 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 3 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 4 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 5 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 6 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 7 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 8 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 9 p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 A p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 B p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 C p 6 s 0 p 0 s 1 d 0 g 0 i 0 s 0 D p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 E p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 F p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 G p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 H p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 I p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 J p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 K p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 L p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 M p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 N p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 O p 6 s 0 p 0 s 0 d 1 g 0 i 0 s 0 P p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 Q p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 R p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 S p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 T p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 U p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 V p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 W p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 X p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 Y p 6 s 0 p 0 s 0 d 0 g 1 i 0 s 0 Z p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 a p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 b p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 c p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 d p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 e p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 f p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 g p 6 s 0 p 0 s 0 d 0 g 0 i 1 s 0 h p 5 s 1 p 1 s 0 d 0 g 0 i 0 s 0 i p 5 s 0 p 1 s 0 d 1 g 0 i 0 s 0 LS STATES FOR LOWEST CONFIGURATION 0.5 1(2S)2S 1 TOTAL 1 29 37 34 23 15 9 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 155 37 1 0 29 66 100 123 138 147 155 155 155 155 155 155 155 155 155 155 155 155 155 155 155 155 0 1 Magnusson, C.E. and Zetterberg, P.O. 1974. Physica Scripta 10, 177-182. 2 3 4 5 6 7 8 9 0 0 0 0 0.300 2.000 8 1.0 60 100 120 100 100 100 50 30 10 10 10 10 10 10 10 0 0 0 0 0 0 0 0 8 1.0 29 37 34 23 15 9 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 15.04 2p6 3s 2p6 4s 2p6 5s 2p6 6s 2p6 7s 2p6 8s 2p6 9s 2p6 10s 2p6 11s 2p6 12s 2p6 13s 2p6 14s 2p6 3d 2p6 4d 2p6 5d 2p6 6d 2p6 7d 2p6 8d 2p6 9d 2p6 10d 2p6 11d 2p6 12d 2p6 13d 2p6 14d 2p6 5g 2p6 6g 2p6 7g 2p6 8g 2p6 9g 2p6 10g 2p6 11g 2p6 12g 2p6 13g 2p6 14g 2p6 7i 2p6 8i 2p6 9i 2p6 10i 2p6 11i 2p6 12i 2p6 13i 2p6 14i 2p5 3s3p 2p5 3p3d SENORITY MIXING CORRECTIONS 0 0.5 0.00 2p6.3s 2S 3s 2S 0 0.5 272959.27 2p6.4s 2S 4s 2S 0 0.5 376645.25 2p6.5s 2S 5s 2S 0 0.5 427185.41 2p6.6s 2S 6s 2S 0 0.5 455602.53 2p6.7s 2S 7s 2S 0 0.5 473161.3 2p6.8s 2S 8s 2S 0 0.5 484768.2 2p6.9s 2S 9s 2S 0 -1.0 0 1.5 204198.99 2p6.3d 2D 3d 2D 0 1.5 345395.62 2p6.4d 2D 4d 2D 0 1.5 410635.53 2p6.5d 2D 5d 2D 0 1.5 445838.8 2p6.6d 2D 6d 2D 0 1.5 466936.1 2p6.7d 2D 7d 2D 0 1.5 480560.1 2p6.8d 2D 8d 2D 0 -1.0 0 2.5 204206.04 2p6.3d 2D 3d 2D 0 2.5 345400.75 2p6.4d 2D 4d 2D 0 2.5 410638.67 2p6.5d 2D 5d 2D 0 2.5 445838.8 2p6.6d 2D 6d 2D 0 2.5 466936.1 2p6.7d 2D 7d 2D 0 2.5 480560.1 2p6.8d 2D 8d 2D 0 -1.0 0 3.5 414686.79 2p6.5g 2G 5g 2G 0 3.5 448230.28 2p6.6g 2G 6g 2G 0 3.5 468456.20 2p6.7g 2G 7g 2G 0 3.5 481584.2 2p6.8g 2G 8g 2G 0 3.5 490584.7 2p6.9g 2G 9g 2G 0 -1.0 0 4.5 414686.79 2p6.5g 2G 5g 2G 0 4.5 448230.28 2p6.6g 2G 6g 2G 0 4.5 468456.20 2p6.7g 2G 7g 2G 0 4.5 481584.2 2p6.8g 2G 8g 2G 0 4.5 490584.7 2p6.9g 2G 9g 2G 0 -1.0 0 5.5 468474.79 2p6.7i 2I 7i 2I 0 5.5 481593.25 P 2p6.8i 2I 8i 2I 0 -1.0 0 6.5 468474.79 2p6.7i 2I 7i 2I 0 6.5 481593.25 P 2p6.8i 2I 8i 2I 0 -1.0 263 1.5 22 LEAST SQUARES 1 1 EAV 2722.5 1.0 0.0 1.000 0 0.0 0 2p6 3s 2 2 EAV 273056.9 1.0 275671.1 1.000 0 -3100.0 0 2p6 4s 3 3 EAV 376685.3 1.0 379639.6 1.000 0 -3100.0 0 2p6 5s 4 4 EAV 427206.2 1.0 430242.5 1.000 0 -3100.0 0 2p6 6s 5 5 EAV 455614.8 1.0 458681.0 1.000 0 -3100.0 0 2p6 7s 6 6 EAV 473169.1 1.0 476248.8 1.000 0 -3100.0 0 2p6 8s 7 7 EAV 484773.5 1.0 487859.4 1.000 0 -3100.0 0 2p6 9s 8 8 EAV 492831.9 0.0 495931.9 FIXEDHF 1.000 0 -3100.0 0 2p6 10s 9 9 EAV 498669.2 0.0 501769.2 FIXEDHF 1.000 0 -3100.0 0 2p6 11s 10 A EAV 503028.4 0.0 506128.4 FIXEDHF 1.000 0 -3100.0 0 2p6 12s 11 B EAV 506369.6 0.0 509469.6 FIXEDHF 1.000 0 -3100.0 0 2p6 13s 12 C EAV 508984.6 0.0 512084.6 FIXEDHF 1.000 0 -3100.0 0 2p6 14s 13 D EAV 206557.5 1.0 205884.1 1.000 0 -3100.0 0 2p6 3d 14 D ZETA 5 4.1 0.0 13.7 FIXED 1.000 0 0.0 0 15 E EAV 345452.5 1.0 348466.1 1.000 0 -3100.0 0 2p6 4d 16 E ZETA 5 2.1 1.0 6.4 1.000 0 0.0 0 17 F EAV 410659.3 1.0 413758.4 1.000 0 -3100.0 0 2p6 5d 18 F ZETA 5 1.3 1.0 3.3 1.000 0 0.0 0 19 G EAV 445850.5 1.0 448954.8 1.000 0 -3100.0 0 2p6 6d 20 G ZETA 5 1.9 0.0 1.9 FIXEDHF 1.000 0 0.0 0 21 H EAV 466943.0 1.0 470044.3 1.000 0 -3100.0 0 2p6 7d 22 H ZETA 5 1.2 0.0 1.2 FIXEDHF 1.000 0 0.0 0 23 I EAV 480564.5 1.0 483664.7 1.000 0 -3100.0 0 2p6 8d 24 I ZETA 5 0.8 0.0 0.8 FIXEDHF 1.000 0 0.0 0 25 J EAV 489864.4 0.0 492964.4 FIXEDHF 1.000 0 -3100.0 0 2p6 9d 26 J ZETA 5 0.6 0.0 0.6 FIXEDHF 1.000 0 0.0 0 27 K EAV 496495.3 0.0 499595.3 FIXEDHF 1.000 0 -3100.0 0 2p6 10d 28 K ZETA 5 0.4 0.0 0.4 FIXEDHF 1.000 0 0.0 0 29 L EAV 501389.6 0.0 504489.6 FIXEDHF 1.000 0 -3100.0 0 2p6 11d 30 L ZETA 5 0.3 0.0 0.3 FIXEDHF 1.000 0 0.0 0 31 M EAV 505101.1 0.0 508201.1 FIXEDHF 1.000 0 -3100.0 0 2p6 12d 32 M ZETA 5 0.2 0.0 0.2 FIXEDHF 1.000 0 0.0 0 33 N EAV 507985.8 0.0 511085.8 FIXEDHF 1.000 0 -3100.0 0 2p6 13d 34 N ZETA 5 0.2 0.0 0.2 FIXEDHF 1.000 0 0.0 0 35 O EAV 510271.2 0.0 513371.2 FIXEDHF 1.000 0 -3100.0 0 2p6 14d 36 O ZETA 5 0.2 0.0 0.2 FIXEDHF 1.000 0 0.0 0 37 P EAV 414686.9 1.0 417743.4 1.000 0 -3100.0 0 2p6 5g 38 P ZETA 6 0.4 0.0 0.4 FIXEDHF 1.000 0 0.0 0 39 Q EAV 448230.4 1.0 451288.6 1.000 0 -3100.0 0 2p6 6g 40 Q ZETA 6 0.3 0.0 0.3 FIXEDHF 1.000 0 0.0 0 41 R EAV 468456.3 1.0 471524.9 1.000 0 -3100.0 0 2p6 7g 42 R ZETA 6 0.2 0.0 0.2 FIXEDHF 1.000 0 0.0 0 43 S EAV 481584.3 1.0 484661.0 1.000 0 -3100.0 0 2p6 8g 44 S ZETA 6 0.1 0.0 0.1 FIXEDHF 1.000 0 0.0 0 45 T EAV 490584.7 1.0 493666.5 1.000 0 -3100.0 0 2p6 9g 46 T ZETA 6 0.1 0.0 0.1 FIXEDHF 1.000 0 0.0 0 47 U EAV 497008.5 0.0 500108.5 FIXEDHF 1.000 0 -3100.0 0 2p6 10g 48 U ZETA 6 0.1 0.0 0.1 FIXEDHF 1.000 0 0.0 0 49 V EAV 501775.2 0.0 504875.2 FIXEDHF 1.000 0 -3100.0 0 2p6 11g 50 V ZETA 6 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 51 W EAV 505398.3 0.0 508498.3 FIXEDHF 1.000 0 -3100.0 0 2p6 12g 52 W ZETA 6 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 53 X EAV 508219.8 0.0 511319.8 FIXEDHF 1.000 0 -3100.0 0 2p6 13g 54 X ZETA 6 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 55 Y EAV 510458.5 0.0 513558.5 FIXEDHF 1.000 0 -3100.0 0 2p6 14g 56 Y ZETA 6 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 57 Z EAV 468474.8 1.0 471572.9 1.000 0 -3100.0 0 2p6 7i 58 Z ZETA 7 0.1 0.0 0.1 FIXEDHF 1.000 0 0.0 0 59 a EAV 481593.3 1.0 484694.9 1.000 0 -3100.0 0 2p6 8i 60 a ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 61 b EAV 490592.1 0.0 493692.1 FIXEDHF 1.000 0 -3100.0 0 2p6 9i 62 b ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 63 c EAV 497027.3 0.0 500127.3 FIXEDHF 1.000 0 -3100.0 0 2p6 10i 64 c ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 65 d EAV 501788.2 0.0 504888.2 FIXEDHF 1.000 0 -3100.0 0 2p6 11i 66 d ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 67 e EAV 505409.7 0.0 508509.7 FIXEDHF 1.000 0 -3100.0 0 2p6 12i 68 e ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 69 f EAV 508229.2 0.0 511329.2 FIXEDHF 1.000 0 -3100.0 0 2p6 13i 70 f ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 71 g EAV 510464.8 0.0 513564.8 FIXEDHF 1.000 0 -3100.0 0 2p6 14i 72 g ZETA 7 0.0 0.0 0.0 FIXEDHF 1.000 0 0.0 0 73 h EAV 1132197.4 0.0 1135297.4 FIXEDHF 1.000 0 -3100.0 0 2p5 3s3p 74 h ZETA 1 4880.8 0.0 4880.8 FIXEDHF 1.000 0 0.0 0 75 h ZETA 3 653.6 0.0 653.6 FIXEDHF 1.000 0 0.0 0 76 h F2(13) 26822.0 0.0 33527.5 FIXEDHF 0.800 0 0.0 0 77 h G1(12) 12359.9 0.0 15449.9 FIXEDHF 0.800 0 0.0 0 78 h G0(13) 12729.2 0.0 15911.5 FIXEDHF 0.800 0 0.0 0 79 h G2(13) 11868.7 0.0 14835.9 FIXEDHF 0.800 0 0.0 0 80 h G1(23) 67463.6 0.0 84329.5 FIXEDHF 0.800 0 0.0 0 81 i EAV 1356211.8 0.0 1359311.8 FIXEDHF 1.000 0 -3100.0 0 2p5 3p3d 82 i ZETA 1 4906.0 0.0 4906.0 FIXEDHF 1.000 0 0.0 0 83 i ZETA 3 660.2 0.0 660.2 FIXEDHF 1.000 0 0.0 0 84 i ZETA 5 23.7 0.0 23.7 FIXEDHF 1.000 0 0.0 0 85 i F2(13) 26970.2 0.0 33712.7 FIXEDHF 0.800 0 0.0 0 86 i F2(15) 22399.0 0.0 27998.8 FIXEDHF 0.800 0 0.0 0 87 i F2(35) 47800.2 0.0 59750.2 FIXEDHF 0.800 0 0.0 0 88 i G0(13) 12760.4 0.0 15950.5 FIXEDHF 0.800 0 0.0 0 89 i G2(13) 11925.2 0.0 14906.5 FIXEDHF 0.800 0 0.0 0 90 i G1(15) 15120.2 0.0 18900.3 FIXEDHF 0.800 0 0.0 0 91 i G3(15) 8571.5 0.0 10714.4 FIXEDHF 0.800 0 0.0 0 92 i G1(35) 58596.2 0.0 73245.3 FIXEDHF 0.800 0 0.0 0 93 i G3(35) 36788.0 0.0 45985.0 FIXEDHF 0.800 0 0.0 0 94 1h 0D1113 6515.0 0.0 8143.7 FIXEDHF 0.800 0 0.0 0 2p6 3s -2p5 3s3p 95 1h 2D1113 29041.3 0.0 36301.6 FIXEDHF 0.800 0 0.0 0 96 1h 1D1223 -6055.1 0.0 -7568.9 FIXEDHF 0.800 0 0.0 0 97 1h 0E1223 -883.9 0.0 -1104.9 FIXEDHF 0.800 0 0.0 0 98 1i 2D1235 -9700.5 0.0 -12125.6 FIXEDHF 0.800 0 0.0 0 2p6 3s -2p5 3p3d 99 1i 1E1235 -23329.0 0.0 -29161.3 FIXEDHF 0.800 0 0.0 0 100 2h 1D1423 -120.6 0.0 -150.8 FIXEDHF 0.800 0 0.0 0 2p6 4s -2p5 3s3p 101 2h 0E1423 2793.6 0.0 3492.0 FIXEDHF 0.800 0 0.0 0 102 2i 2D1435 -2954.1 0.0 -3692.6 FIXEDHF 0.800 0 0.0 0 2p6 4s -2p5 3p3d 103 2i 1E1435 -6771.3 0.0 -8464.1 FIXEDHF 0.800 0 0.0 0 104 3h 1D1423 256.0 0.0 320.0 FIXEDHF 0.800 0 0.0 0 2p6 5s -2p5 3s3p 105 3h 0E1423 1837.7 0.0 2297.1 FIXEDHF 0.800 0 0.0 0 106 3i 2D1435 -1669.9 0.0 -2087.4 FIXEDHF 0.800 0 0.0 0 2p6 5s -2p5 3p3d 107 3i 1E1435 -3814.1 0.0 -4767.6 FIXEDHF 0.800 0 0.0 0 108 4h 1D1423 280.8 0.0 351.0 FIXEDHF 0.800 0 0.0 0 2p6 6s -2p5 3s3p 109 4h 0E1423 1328.3 0.0 1660.4 FIXEDHF 0.800 0 0.0 0 110 4i 2D1435 -1126.6 0.0 -1408.2 FIXEDHF 0.800 0 0.0 0 2p6 6s -2p5 3p3d 111 4i 1E1435 -2575.9 0.0 -3219.9 FIXEDHF 0.800 0 0.0 0 112 5h 1D1423 252.9 0.0 316.1 FIXEDHF 0.800 0 0.0 0 2p6 7s -2p5 3s3p 113 5h 0E1423 1018.7 0.0 1273.4 FIXEDHF 0.800 0 0.0 0 114 5i 2D1435 -832.0 0.0 -1040.0 FIXEDHF 0.800 0 0.0 0 2p6 7s -2p5 3p3d 115 5i 1E1435 -1904.9 0.0 -2381.1 FIXEDHF 0.800 0 0.0 0 116 6h 1D1423 219.6 0.0 274.5 FIXEDHF 0.800 0 0.0 0 2p6 8s -2p5 3s3p 117 6h 0E1423 813.8 0.0 1017.2 FIXEDHF 0.800 0 0.0 0 118 6i 2D1435 -649.4 0.0 -811.8 FIXEDHF 0.800 0 0.0 0 2p6 8s -2p5 3p3d 119 6i 1E1435 -1488.5 0.0 -1860.6 FIXEDHF 0.800 0 0.0 0 120 7h 1D1423 190.0 0.0 237.5 FIXEDHF 0.800 0 0.0 0 2p6 9s -2p5 3s3p 121 7h 0E1423 669.5 0.0 836.9 FIXEDHF 0.800 0 0.0 0 122 7i 2D1435 -526.4 0.0 -658.0 FIXEDHF 0.800 0 0.0 0 2p6 9s -2p5 3p3d 123 7i 1E1435 -1207.3 0.0 -1509.1 FIXEDHF 0.800 0 0.0 0 124 8h 1D1423 165.3 0.0 206.6 FIXEDHF 0.800 0 0.0 0 2p6 10s -2p5 3s3p 125 8h 0E1423 563.6 0.0 704.5 FIXEDHF 0.800 0 0.0 0 126 8i 2D1435 -438.5 0.0 -548.1 FIXEDHF 0.800 0 0.0 0 2p6 10s -2p5 3p3d 127 8i 1E1435 -1006.2 0.0 -1257.7 FIXEDHF 0.800 0 0.0 0 128 9h 1D1423 145.0 0.0 181.2 FIXEDHF 0.800 0 0.0 0 2p6 11s -2p5 3s3p 129 9h 0E1423 483.0 0.0 603.7 FIXEDHF 0.800 0 0.0 0 130 9i 2D1435 -372.9 0.0 -466.1 FIXEDHF 0.800 0 0.0 0 2p6 11s -2p5 3p3d 131 9i 1E1435 -856.1 0.0 -1070.1 FIXEDHF 0.800 0 0.0 0 132 Ah 1D1423 128.2 0.0 160.2 FIXEDHF 0.800 0 0.0 0 2p6 12s -2p5 3s3p 133 Ah 0E1423 419.9 0.0 524.9 FIXEDHF 0.800 0 0.0 0 134 Ai 2D1435 -322.4 0.0 -403.0 FIXEDHF 0.800 0 0.0 0 2p6 12s -2p5 3p3d 135 Ai 1E1435 -740.4 0.0 -925.5 FIXEDHF 0.800 0 0.0 0 136 Bh 1D1423 114.2 0.0 142.8 FIXEDHF 0.800 0 0.0 0 2p6 13s -2p5 3s3p 137 Bh 0E1423 369.5 0.0 461.9 FIXEDHF 0.800 0 0.0 0 138 Bi 2D1435 -282.5 0.0 -353.1 FIXEDHF 0.800 0 0.0 0 2p6 13s -2p5 3p3d 139 Bi 1E1435 -648.9 0.0 -811.1 FIXEDHF 0.800 0 0.0 0 140 Ch 1D1423 102.5 0.0 128.1 FIXEDHF 0.800 0 0.0 0 2p6 14s -2p5 3s3p 141 Ch 0E1423 328.5 0.0 410.6 FIXEDHF 0.800 0 0.0 0 142 Ci 2D1435 -250.2 0.0 -312.8 FIXEDHF 0.800 0 0.0 0 2p6 14s -2p5 3p3d 143 Ci 1E1435 -575.0 0.0 -718.7 FIXEDHF 0.800 0 0.0 0 144 Dh 1D1523 -8816.8 0.0 -11021.0 FIXEDHF 0.800 0 0.0 0 2p6 3d -2p5 3s3p 145 Dh 2E1523 -8961.6 0.0 -11202.0 FIXEDHF 0.800 0 0.0 0 146 Di 0D1113 6523.9 0.0 8154.9 FIXEDHF 0.800 0 0.0 0 2p6 3d -2p5 3p3d 147 Di 2D1113 29113.4 0.0 36391.7 FIXEDHF 0.800 0 0.0 0 148 Di 0D1535 -1526.2 0.0 -1907.7 FIXEDHF 0.800 0 0.0 0 149 Di 2D1535 -7628.0 0.0 -9535.0 FIXEDHF 0.800 0 0.0 0 150 Di 1E1535 -18534.8 0.0 -23168.5 FIXEDHF 0.800 0 0.0 0 151 Di 3E1535 -8305.1 0.0 -10381.4 FIXEDHF 0.800 0 0.0 0 152 Eh 1D1523 -3463.4 0.0 -4329.3 FIXEDHF 0.800 0 0.0 0 2p6 4d -2p5 3s3p 153 Eh 2E1523 -4275.2 0.0 -5344.0 FIXEDHF 0.800 0 0.0 0 154 Ei 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 4d -2p5 3p3d 155 Ei 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 156 Ei 0D1535 1508.3 0.0 1885.4 FIXEDHF 0.800 0 0.0 0 157 Ei 2D1535 -3124.5 0.0 -3905.6 FIXEDHF 0.800 0 0.0 0 158 Ei 1E1535 -7350.6 0.0 -9188.2 FIXEDHF 0.800 0 0.0 0 159 Ei 3E1535 -4076.1 0.0 -5095.1 FIXEDHF 0.800 0 0.0 0 160 Fh 1D1523 -1948.6 0.0 -2435.8 FIXEDHF 0.800 0 0.0 0 2p6 5d -2p5 3s3p 161 Fh 2E1523 -2589.5 0.0 -3236.9 FIXEDHF 0.800 0 0.0 0 162 Fi 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 5d -2p5 3p3d 163 Fi 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 164 Fi 0D1535 1074.6 0.0 1343.2 FIXEDHF 0.800 0 0.0 0 165 Fi 2D1535 -1768.1 0.0 -2210.1 FIXEDHF 0.800 0 0.0 0 166 Fi 1E1535 -4101.8 0.0 -5127.2 FIXEDHF 0.800 0 0.0 0 167 Fi 3E1535 -2483.5 0.0 -3104.4 FIXEDHF 0.800 0 0.0 0 168 Gh 1D1523 -1297.8 0.0 -1622.2 FIXEDHF 0.800 0 0.0 0 2p6 6d -2p5 3s3p 169 Gh 2E1523 -1790.6 0.0 -2238.2 FIXEDHF 0.800 0 0.0 0 170 Gi 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 6d -2p5 3p3d 171 Gi 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 172 Gi 0D1535 810.2 0.0 1012.8 FIXEDHF 0.800 0 0.0 0 173 Gi 2D1535 -1174.8 0.0 -1468.5 FIXEDHF 0.800 0 0.0 0 174 Gi 1E1535 -2706.5 0.0 -3383.1 FIXEDHF 0.800 0 0.0 0 175 Gi 3E1535 -1718.6 0.0 -2148.3 FIXEDHF 0.800 0 0.0 0 176 Hh 1D1523 -949.7 0.0 -1187.1 FIXEDHF 0.800 0 0.0 0 2p6 7d -2p5 3s3p 177 Hh 2E1523 -1339.3 0.0 -1674.1 FIXEDHF 0.800 0 0.0 0 178 Hi 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 7d -2p5 3p3d 179 Hi 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 180 Hi 0D1535 638.2 0.0 797.8 FIXEDHF 0.800 0 0.0 0 181 Hi 2D1535 -856.6 0.0 -1070.7 FIXEDHF 0.800 0 0.0 0 182 Hi 1E1535 -1965.5 0.0 -2456.9 FIXEDHF 0.800 0 0.0 0 183 Hi 3E1535 -1285.0 0.0 -1606.2 FIXEDHF 0.800 0 0.0 0 184 Ih 1D1523 -737.1 0.0 -921.4 FIXEDHF 0.800 0 0.0 0 2p6 8d -2p5 3s3p 185 Ih 2E1523 -1054.2 0.0 -1317.7 FIXEDHF 0.800 0 0.0 0 186 Ii 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 8d -2p5 3p3d 187 Ii 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 188 Ii 0D1535 519.4 0.0 649.3 FIXEDHF 0.800 0 0.0 0 189 Ii 2D1535 -662.6 0.0 -828.3 FIXEDHF 0.800 0 0.0 0 190 Ii 1E1535 -1516.7 0.0 -1895.9 FIXEDHF 0.800 0 0.0 0 191 Ii 3E1535 -1010.6 0.0 -1263.3 FIXEDHF 0.800 0 0.0 0 192 Jh 1D1523 -595.4 0.0 -744.3 FIXEDHF 0.800 0 0.0 0 2p6 9d -2p5 3s3p 193 Jh 2E1523 -859.6 0.0 -1074.5 FIXEDHF 0.800 0 0.0 0 194 Ji 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 9d -2p5 3p3d 195 Ji 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 196 Ji 0D1535 433.4 0.0 541.7 FIXEDHF 0.800 0 0.0 0 197 Ji 2D1535 -533.8 0.0 -667.2 FIXEDHF 0.800 0 0.0 0 198 Ji 1E1535 -1219.8 0.0 -1524.7 FIXEDHF 0.800 0 0.0 0 199 Ji 3E1535 -823.7 0.0 -1029.6 FIXEDHF 0.800 0 0.0 0 200 Kh 1D1523 -495.0 0.0 -618.8 FIXEDHF 0.800 0 0.0 0 2p6 10d -2p5 3s3p 201 Kh 2E1523 -719.5 0.0 -899.4 FIXEDHF 0.800 0 0.0 0 202 Ki 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 10d -2p5 3p3d 203 Ki 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 204 Ki 0D1535 368.7 0.0 460.9 FIXEDHF 0.800 0 0.0 0 205 Ki 2D1535 -442.8 0.0 -553.5 FIXEDHF 0.800 0 0.0 0 206 Ki 1E1535 -1010.6 0.0 -1263.3 FIXEDHF 0.800 0 0.0 0 207 Ki 3E1535 -689.0 0.0 -861.3 FIXEDHF 0.800 0 0.0 0 208 Lh 1D1523 -420.6 0.0 -525.8 FIXEDHF 0.800 0 0.0 0 2p6 11d -2p5 3s3p 209 Lh 2E1523 -614.5 0.0 -768.1 FIXEDHF 0.800 0 0.0 0 210 Li 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 11d -2p5 3p3d 211 Li 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 212 Li 0D1535 318.7 0.0 398.4 FIXEDHF 0.800 0 0.0 0 213 Li 2D1535 -375.6 0.0 -469.5 FIXEDHF 0.800 0 0.0 0 214 Li 1E1535 -856.5 0.0 -1070.6 FIXEDHF 0.800 0 0.0 0 215 Li 3E1535 -588.2 0.0 -735.2 FIXEDHF 0.800 0 0.0 0 216 Mh 1D1523 -363.6 0.0 -454.5 FIXEDHF 0.800 0 0.0 0 2p6 12d -2p5 3s3p 217 Mh 2E1523 -533.1 0.0 -666.4 FIXEDHF 0.800 0 0.0 0 218 Mi 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 12d -2p5 3p3d 219 Mi 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 220 Mi 0D1535 279.0 0.0 348.8 FIXEDHF 0.800 0 0.0 0 221 Mi 2D1535 -324.2 0.0 -405.2 FIXEDHF 0.800 0 0.0 0 222 Mi 1E1535 -738.7 0.0 -923.4 FIXEDHF 0.800 0 0.0 0 223 Mi 3E1535 -510.1 0.0 -637.6 FIXEDHF 0.800 0 0.0 0 224 Nh 1D1523 -318.6 0.0 -398.2 FIXEDHF 0.800 0 0.0 0 2p6 13d -2p5 3s3p 225 Nh 2E1523 -468.5 0.0 -585.6 FIXEDHF 0.800 0 0.0 0 226 Ni 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 13d -2p5 3p3d 227 Ni 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 228 Ni 0D1535 247.0 0.0 308.7 FIXEDHF 0.800 0 0.0 0 229 Ni 2D1535 -283.7 0.0 -354.6 FIXEDHF 0.800 0 0.0 0 230 Ni 1E1535 -646.2 0.0 -807.7 FIXEDHF 0.800 0 0.0 0 231 Ni 3E1535 -448.2 0.0 -560.2 FIXEDHF 0.800 0 0.0 0 232 Oh 1D1523 -282.3 0.0 -352.9 FIXEDHF 0.800 0 0.0 0 2p6 14d -2p5 3s3p 233 Oh 2E1523 -416.2 0.0 -520.2 FIXEDHF 0.800 0 0.0 0 234 Oi 0D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 2p6 14d -2p5 3p3d 235 Oi 2D1113 0.0 0.0 0.0 FIXEDHF 0.800 0 0.0 0 236 Oi 0D1535 220.6 0.0 275.8 FIXEDHF 0.800 0 0.0 0 237 Oi 2D1535 -251.2 0.0 -314.0 FIXEDHF 0.800 0 0.0 0 238 Oi 1E1535 -571.8 0.0 -714.8 FIXEDHF 0.800 0 0.0 0 239 Oi 3E1535 -398.0 0.0 -497.5 FIXEDHF 0.800 0 0.0 0 240 Pi 2D1635 -651.4 0.0 -814.3 FIXEDHF 0.800 0 0.0 0 2p6 5g -2p5 3p3d 241 Pi 3E1635 -478.6 0.0 -598.3 FIXEDHF 0.800 0 0.0 0 242 Qi 2D1635 -619.4 0.0 -774.3 FIXEDHF 0.800 0 0.0 0 2p6 6g -2p5 3p3d 243 Qi 3E1635 -472.8 0.0 -591.0 FIXEDHF 0.800 0 0.0 0 244 Ri 2D1635 -541.6 0.0 -677.0 FIXEDHF 0.800 0 0.0 0 2p6 7g -2p5 3p3d 245 Ri 3E1635 -422.2 0.0 -527.7 FIXEDHF 0.800 0 0.0 0 246 Si 2D1635 -467.6 0.0 -584.5 FIXEDHF 0.800 0 0.0 0 2p6 8g -2p5 3p3d 247 Si 3E1635 -369.2 0.0 -461.5 FIXEDHF 0.800 0 0.0 0 248 Ti 2D1635 -405.2 0.0 -506.5 FIXEDHF 0.800 0 0.0 0 2p6 9g -2p5 3p3d 249 Ti 3E1635 -322.6 0.0 -403.3 FIXEDHF 0.800 0 0.0 0 250 Ui 2D1635 -353.8 0.0 -442.2 FIXEDHF 0.800 0 0.0 0 2p6 10g -2p5 3p3d 251 Ui 3E1635 -283.4 0.0 -354.3 FIXEDHF 0.800 0 0.0 0 252 Vi 2D1635 -311.5 0.0 -389.4 FIXEDHF 0.800 0 0.0 0 2p6 11g -2p5 3p3d 253 Vi 3E1635 -250.7 0.0 -313.4 FIXEDHF 0.800 0 0.0 0 254 Wi 2D1635 -276.6 0.0 -345.8 FIXEDHF 0.800 0 0.0 0 2p6 12g -2p5 3p3d 255 Wi 3E1635 -223.4 0.0 -279.3 FIXEDHF 0.800 0 0.0 0 256 Xi 2D1635 -247.6 0.0 -309.5 FIXEDHF 0.800 0 0.0 0 2p6 13g -2p5 3p3d 257 Xi 3E1635 -200.5 0.0 -250.6 FIXEDHF 0.800 0 0.0 0 258 Yi 2D1635 -223.1 0.0 -278.9 FIXEDHF 0.800 0 0.0 0 2p6 14g -2p5 3p3d 259 Yi 3E1635 -181.0 0.0 -226.3 FIXEDHF 0.800 0 0.0 0 260 hi 2D1215 11209.7 0.0 14012.1 FIXEDHF 0.800 0 0.0 0 2p5 3s3p -2p5 3p3d 261 hi 1E1215 -3769.4 0.0 -4711.7 FIXEDHF 0.800 0 0.0 0 262 hi 1D2335 61890.4 0.0 77363.0 FIXEDHF 0.800 0 0.0 0 263 hi 2E2335 47267.4 0.0 59084.2 FIXEDHF 0.800 0 0.0 0 15.04 J 0.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 0.00 0.030 0.0 2.002 3s 2S 0.999 1(2S)2S 1 0.036 h(3P)2S 18 2 272959.27 272959.243 0.0 2.002 4s 2S -1.000 2(2S)2S 2 3 376645.25 376645.276 0.0 2.002 5s 2S 1.000 3(2S)2S 3 4 427185.41 427185.401 0.0 2.002 6s 2S 1.000 4(2S)2S 4 5 455602.53 455602.538 0.0 2.002 7s 2S 1.000 5(2S)2S 5 6 473161.3 473161.251 0.0 2.002 8s 2S -1.000 6(2S)2S 6 7 484768.2 484768.172 0.0 2.002 9s 2S -1.000 7(2S)2S 7 8 492828.117 2.002 -1.000 8(2S)2S 8 9 498666.417 2.002 1.000 9(2S)2S 9 10 503026.294 2.002 -1.000 A(2S)2S 10 11 506367.968 2.002 -1.000 B(2S)2S 11 12 508983.310 2.002 -1.000 C(2S)2S 12 13 1116027.775 0.170 0.937 h(3P)4D 13 -0.223 h(1P)2P 15 -0.216 h(3P)4P 14 14 1121925.696 2.444 0.944 h(3P)4P 14 0.257 h(3P)4D 13 -0.146 h(1P)2S 17 15 1126114.567 0.708 -0.775 h(1P)2P 15 -0.552 h(3P)2P 16 -0.225 h(3P)4D 13 16 1136868.357 1.999 -0.928 h(1P)2S 17 0.283 h(3P)2S 18 -0.162 h(3P)4P 14 17 1162330.870 0.686 0.799 h(3P)2P 16 -0.557 h(1P)2P 15 0.155 i(3D)2P 27 18 1196908.638 1.997 0.942 h(3P)2S 18 0.285 h(1P)2S 17 0.158 i(3D)2S 29 19 1325980.110 -0.002 -0.810 i(3S)4D 19 -0.494 i(3P)4D 20 -0.314 i(3D)4D 21 20 1340950.166 0.665 -0.642 i(3P)2P 26 0.511 i(1P)2P 24 0.428 i(1D)2P 25 J 0.5 21 1349816.461 2.616 -0.916 i(3D)4P 23 -0.356 i(3P)4P 22 0.116 i(1D)2S 28 22 1354146.454 0.070 0.660 i(3P)4D 20 -0.561 i(3S)4D 19 0.426 i(3D)4D 21 23 1359446.707 0.195 0.753 i(3D)4D 21 -0.431 i(3P)4D 20 -0.355 i(1D)2P 25 24 1363528.003 2.331 -0.781 i(3P)4P 22 -0.475 i(1D)2S 28 0.243 i(3D)4P 23 25 1364430.881 0.731 0.497 i(1D)2P 25 -0.485 i(1P)2P 24 -0.364 i(3P)4D 20 26 1369466.411 2.035 -0.829 i(1D)2S 28 0.360 i(3P)4P 22 -0.271 i(3D)4P 23 27 1373349.530 0.692 -0.537 i(1D)2P 25 -0.536 i(3P)2P 26 -0.484 i(1P)2P 24 28 1389315.169 1.814 0.896 i(3D)2S 29 -0.297 i(3D)2P 27 -0.162 i(1D)2S 28 29 1398457.000 0.855 -0.683 i(3D)2P 27 0.391 i(3P)2P 26 -0.353 i(3D)2S 29 15.04 J 1.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 204198.99 204197.751 -1.2 0.800 3d 2D 0.999 D(1S)2D 1 -0.043 i(1S)2D 28 2 345395.62 345395.531 -0.1 0.800 4d 2D -1.000 E(1S)2D 2 3 410635.53 410635.477 -0.1 0.800 5d 2D 1.000 F(1S)2D 3 4 445838.8 445836.421 -2.4 0.800 6d 2D -1.000 G(1S)2D 4 5 466936.1 466934.609 -1.5 0.800 7d 2D -1.000 H(1S)2D 5 6 480560.1 480559.079 -1.0 0.800 8d 2D 1.000 I(1S)2D 6 7 489860.626 0.800 1.000 J(1S)2D 7 8 496492.651 0.800 -1.000 K(1S)2D 8 9 501387.636 0.800 1.000 L(1S)2D 9 10 505099.649 0.800 -1.000 M(1S)2D 10 11 507984.605 0.800 -1.000 N(1S)2D 11 12 510270.189 0.800 1.000 O(1S)2D 12 13 1103163.024 1.992 0.982 h(3P)4S 15 -0.152 h(3P)4P 14 0.076 i(3D)4S 27 14 1114369.064 1.211 0.918 h(3P)4D 13 -0.249 h(3P)4P 14 0.216 h(1P)2D 16 15 1120530.399 1.427 -0.774 h(3P)4P 14 -0.457 h(1P)2D 16 -0.275 h(3P)2D 17 16 1124194.107 1.081 -0.676 h(1P)2D 16 0.489 h(3P)4P 14 -0.411 h(3P)2D 17 17 1127965.869 1.360 0.754 h(1P)2P 18 0.556 h(3P)2P 19 -0.271 h(3P)4P 14 18 1156195.009 1.096 0.587 h(3P)2P 19 -0.561 h(3P)2D 17 -0.435 h(1P)2P 18 19 1161703.475 1.038 -0.625 h(3P)2D 17 -0.528 h(3P)2P 19 0.387 h(1P)2P 18 20 1326606.238 1.193 -0.814 i(3S)4D 22 -0.476 i(3P)4D 23 -0.315 i(3D)4D 24 J 1.5 21 1336849.658 0.870 -0.608 i(3S)2D 31 0.489 i(3D)2D 33 -0.307 i(1D)2D 30 22 1343283.492 0.537 0.692 i(3P)4F 20 0.595 i(3D)4F 21 0.222 i(3P)2P 36 23 1345910.042 1.160 0.504 i(3P)2P 36 -0.435 i(1P)2P 34 -0.399 i(1D)2P 35 24 1348236.795 1.900 0.816 i(3D)4S 27 -0.544 i(3D)4P 26 -0.085 i(1P)2P 34 25 1350708.918 1.764 0.738 i(3D)4P 26 0.517 i(3D)4S 27 0.316 i(3P)4P 25 26 1353384.955 1.176 0.689 i(3P)4D 23 -0.513 i(3S)4D 22 0.346 i(3D)4D 24 27 1356643.789 0.868 -0.768 i(1P)2D 29 -0.392 i(3P)2D 32 0.335 i(3D)4D 24 28 1358146.898 0.788 0.449 i(3D)4F 21 -0.445 i(3P)4F 20 -0.399 i(3D)4D 24 29 1360671.089 0.895 -0.634 i(3D)4D 24 -0.480 i(3D)4F 21 0.387 i(3P)4F 20 30 1363734.144 1.086 -0.515 i(1D)2D 30 0.429 i(3P)4P 25 -0.369 i(1D)2P 35 31 1364891.524 1.290 0.647 i(3P)4P 25 0.492 i(1D)2D 30 0.254 i(3P)4D 23 32 1365741.916 1.403 -0.575 i(1P)2P 34 0.439 i(3P)4P 25 -0.382 i(3P)2P 36 33 1372920.791 1.339 -0.580 i(1D)2P 35 -0.520 i(3P)2P 36 -0.393 i(1P)2P 34 34 1374197.295 0.804 0.657 i(3S)2D 31 0.601 i(3D)2D 33 0.310 i(3P)2D 32 35 1392094.785 1.182 0.629 i(3D)2P 37 0.448 i(3P)2D 32 -0.350 i(3P)2P 36 36 1397348.509 0.949 0.689 i(3P)2D 32 -0.395 i(3D)2P 37 -0.312 i(1P)2D 29 37 1424567.893 0.800 -0.970 i(1S)2D 28 0.161 i(3D)2D 33 0.142 i(3S)2D 31 15.04 J 2.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 204206.04 204207.185 1.1 1.200 3d 2D 0.999 D(1S)2D 1 -0.043 i(1S)2D 29 2 345400.75 345400.747 0.0 1.200 4d 2D -1.000 E(1S)2D 2 3 410638.67 410638.711 0.0 1.200 5d 2D 1.000 F(1S)2D 3 4 445838.8 445841.162 2.4 1.200 6d 2D -1.000 G(1S)2D 4 5 466936.1 466937.603 1.5 1.200 7d 2D 1.000 H(1S)2D 5 6 480560.1 480561.075 1.0 1.200 8d 2D -1.000 I(1S)2D 6 7 489862.124 1.200 1.000 J(1S)2D 7 8 496493.650 1.200 -1.000 K(1S)2D 8 9 501388.385 1.200 1.000 L(1S)2D 9 10 505100.148 1.200 1.000 M(1S)2D 10 11 507985.104 1.200 -1.000 N(1S)2D 11 12 510270.689 1.200 1.000 O(1S)2D 12 13 1112832.530 1.378 0.944 h(3P)4D 13 -0.243 h(3P)4P 14 0.177 h(1P)2D 15 14 1119031.372 1.543 -0.917 h(3P)4P 14 -0.309 h(1P)2D 15 -0.189 h(3P)2D 16 15 1126755.469 1.253 0.761 h(1P)2D 15 0.490 h(3P)2D 16 -0.309 h(3P)4P 14 16 1153196.039 1.200 -0.827 h(3P)2D 16 0.532 h(1P)2D 15 0.117 i(3P)2D 33 17 1327660.544 1.363 -0.821 i(3S)4D 20 -0.445 i(3P)4D 21 -0.317 i(3D)4D 22 18 1335254.986 0.639 -0.913 i(3D)4G 17 0.182 i(3P)4F 18 0.181 i(1P)2F 25 19 1335759.541 1.140 -0.624 i(3S)2D 32 0.501 i(3D)2D 34 -0.329 i(1D)2D 31 20 1343468.554 0.911 -0.500 i(3D)2F 28 -0.492 i(3P)4F 18 -0.451 i(1P)2F 25 J 2.5 21 1344336.310 0.980 0.513 i(3P)4F 18 0.465 i(3D)4F 19 -0.458 i(1P)2F 25 22 1346821.340 0.863 -0.621 i(3P)2F 27 -0.593 i(1D)2F 26 0.317 i(3D)2F 28 23 1349946.281 1.582 0.949 i(3D)4P 24 -0.212 i(3D)4D 22 0.163 i(3P)4P 23 24 1352424.548 1.351 0.737 i(3P)4D 21 -0.479 i(3S)4D 20 0.301 i(3D)4D 22 25 1356227.788 1.256 -0.547 i(3D)4D 22 0.534 i(1P)2D 30 0.318 i(3D)4F 19 26 1357052.276 1.061 -0.485 i(3P)4F 18 0.484 i(3D)4F 19 -0.389 i(1P)2D 30 27 1358255.000 1.183 -0.511 i(3D)4D 22 -0.459 i(1P)2D 30 -0.301 i(1D)2F 26 28 1362674.991 1.048 -0.480 i(1D)2F 26 0.393 i(3D)4F 19 0.386 i(3D)4D 22 29 1365149.220 1.449 0.792 i(3P)4P 23 0.348 i(1D)2D 31 -0.179 i(3D)4P 24 30 1366312.020 1.289 0.682 i(1D)2D 31 -0.476 i(3P)4P 23 0.414 i(3D)2D 34 31 1374286.156 1.198 0.667 i(3S)2D 32 0.622 i(3D)2D 34 -0.259 i(1D)2D 31 32 1390741.683 1.024 -0.582 i(3P)2D 33 0.518 i(3P)2F 27 0.329 i(3D)2F 28 33 1395059.731 1.040 -0.618 i(3P)2D 33 -0.489 i(3P)2F 27 -0.320 i(3D)2F 28 34 1425013.546 1.200 -0.966 i(1S)2D 29 0.147 i(3S)2D 32 0.146 i(3D)2D 34 15.04 J 3.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 414686.79 414685.855 -0.9 0.889 5g 2G 1.000 P(1S)2G 1 2 448230.28 448229.607 -0.7 0.889 6g 2G 1.000 Q(1S)2G 2 3 468456.20 468455.767 -0.4 0.889 7g 2G -1.000 R(1S)2G 3 4 481584.2 481584.025 -0.2 0.889 8g 2G -1.000 S(1S)2G 4 5 490584.7 490584.431 -0.3 0.889 9g 2G 1.000 T(1S)2G 5 6 497008.235 0.889 -1.000 U(1S)2G 6 7 501775.189 0.889 1.000 V(1S)2G 7 8 505398.291 0.889 -1.000 W(1S)2G 8 9 508219.793 0.889 1.000 X(1S)2G 9 10 510458.494 0.889 -1.000 Y(1S)2G 10 11 1111649.596 1.430 -0.998 h(3P)4D 11 -0.047 i(3D)4D 17 -0.038 i(3S)4D 15 12 1329189.468 1.419 0.833 i(3S)4D 15 0.393 i(3P)4D 16 0.323 i(3D)4D 17 13 1333609.116 0.981 -0.908 i(3D)4G 12 -0.315 i(1D)2G 18 -0.187 i(3D)2G 19 14 1338254.101 1.096 -0.677 i(3D)2F 23 -0.423 i(1P)2F 20 -0.373 i(1D)2G 18 15 1339363.777 1.015 0.618 i(1D)2G 18 0.383 i(3D)2G 19 -0.356 i(3D)2F 23 16 1344613.037 1.172 -0.637 i(3P)4F 13 -0.579 i(3D)4F 14 -0.314 i(3D)4G 12 17 1346584.972 1.157 0.587 i(1P)2F 20 0.529 i(1D)2F 21 0.476 i(3P)2F 22 18 1351581.820 1.406 -0.802 i(3P)4D 16 0.424 i(3S)4D 15 -0.266 i(3D)4D 17 19 1355497.860 1.326 -0.565 i(3D)4D 17 0.555 i(3D)4F 14 -0.437 i(3P)4F 13 20 1356414.681 1.314 0.657 i(3D)4D 17 0.385 i(3D)4F 14 -0.371 i(3P)4F 13 J 3.5 21 1364716.083 1.183 -0.608 i(1D)2F 21 0.455 i(1P)2F 20 -0.371 i(3D)2F 23 22 1385258.894 0.946 0.748 i(3D)2G 19 -0.463 i(1D)2G 18 -0.343 i(3P)2F 22 23 1392881.938 1.086 0.638 i(3P)2F 22 0.407 i(3D)2F 23 0.407 i(3D)2G 19 15.04 J 4.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 414686.79 414687.654 0.9 1.111 5g 2G 1.000 P(1S)2G 1 2 448230.28 448230.957 0.7 1.111 6g 2G 1.000 Q(1S)2G 2 3 468456.20 468456.667 0.5 1.111 7g 2G -1.000 R(1S)2G 3 4 481584.2 481584.475 0.3 1.111 8g 2G 1.000 S(1S)2G 4 5 490584.7 490584.881 0.2 1.111 9g 2G 1.000 T(1S)2G 5 6 497008.685 1.111 1.000 U(1S)2G 6 7 501775.188 1.111 -1.000 V(1S)2G 7 8 505398.291 1.111 1.000 W(1S)2G 8 9 508219.793 1.111 1.000 X(1S)2G 9 10 510458.494 1.111 1.000 Y(1S)2G 10 11 1332579.257 1.170 -0.953 i(3D)4G 11 -0.237 i(1D)2G 14 -0.136 i(3D)2G 15 12 1339874.718 1.211 0.629 i(1D)2G 14 0.508 i(3P)4F 12 0.430 i(3D)4F 13 13 1345714.858 1.237 -0.541 i(3P)4F 12 0.526 i(1D)2G 14 -0.498 i(3D)4F 13 14 1354646.379 1.334 0.750 i(3D)4F 13 -0.661 i(3P)4F 12 15 1381452.548 1.111 0.854 i(3D)2G 15 -0.521 i(1D)2G 14 15.04 J 5.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 468474.79 468474.450 -0.3 0.923 7i 2I 1.000 Z(1S)2I 1 2 481593.25 P 481593.300 0.0 0.923 8i 2I 1.000 a(1S)2I 2 3 490592.100 0.923 1.000 b(1S)2I 3 4 497027.300 0.923 1.000 c(1S)2I 4 5 501788.200 0.923 1.000 d(1S)2I 5 6 505409.700 0.923 1.000 e(1S)2I 6 7 508229.200 0.923 1.000 f(1S)2I 7 8 510464.800 0.923 1.000 g(1S)2I 8 9 1331782.255 1.273 1.000 i(3D)4G 9 15.04 J 6.5 1 2p6 3s 2 2p6 4s 3 2p6 5s 4 2p6 6s 5 2p6 7s 6 2p6 8s 7 2p6 9s 8 2p6 10s 9 2p6 11s A 2p6 12s B 2p6 13s C 2p6 14s D 2p6 3d E 2p6 4d F 2p6 5d G 2p6 6d H 2p6 7d I 2p6 8d J 2p6 9d K 2p6 10d L 2p6 11d M 2p6 12d N 2p6 13d O 2p6 14d P 2p6 5g Q 2p6 6g R 2p6 7g S 2p6 8g T 2p6 9g U 2p6 10g V 2p6 11g W 2p6 12g X 2p6 13g Y 2p6 14g Z 2p6 7i a 2p6 8i b 2p6 9i c 2p6 10i d 2p6 11i e 2p6 12i f 2p6 13i g 2p6 14i h 2p5 3s3p i 2p5 3p3d OBSERVED OBSERVED CALC OBSERVED ENERGY EIGENVALUE E-O G G LABEL PRINCIPAL EIGENVECTOR COMPONENTS 1 468474.79 468475.100 0.3 1.077 7i 2I 1.000 Z(1S)2I 1 2 481593.25 P 481593.300 0.0 1.077 8i 2I 1.000 a(1S)2I 2 3 490592.100 1.077 1.000 b(1S)2I 3 4 497027.300 1.077 1.000 c(1S)2I 4 5 501788.200 1.077 1.000 d(1S)2I 5 6 505409.700 1.077 1.000 e(1S)2I 6 7 508229.200 1.077 1.000 f(1S)2I 7 8 510464.800 1.077 1.000 g(1S)2I 8 15.04 PARAMETER VARIANCE CHANGE NEW HF RATIO CONSTRAINTS 2p6 3s 1 1 EAV 2722.5 1.5 0.0 2722.5 0.0 0.000 1.000 0 0.0 0 2p6 4s 2 2 EAV 273056.9 1.5 0.0 273056.9 275671.1 0.000 1.000 0 -3100.0 0 2p6 5s 3 3 EAV 376685.3 1.5 0.0 376685.3 379639.6 0.000 1.000 0 -3100.0 0 2p6 6s 4 4 EAV 427206.2 1.5 0.0 427206.2 430242.5 0.000 1.000 0 -3100.0 0 2p6 7s 5 5 EAV 455614.8 1.5 0.0 455614.8 458681.0 0.000 1.000 0 -3100.0 0 2p6 8s 6 6 EAV 473169.1 1.5 0.0 473169.1 476248.8 0.000 1.000 0 -3100.0 0 2p6 9s 7 7 EAV 484773.5 1.5 0.0 484773.5 487859.4 0.000 1.000 0 -3100.0 0 2p6 10s 8 8 EAV 492831.9 0.0 0.0 492831.9 495931.9 0.000 FIXEDHF 1.000 0 -3100.0 0 2p6 11s 9 9 EAV 498669.2 0.0 0.0 498669.2 501769.2 0.000 FIXEDHF 1.000 0 -3100.0 0 2p6 12s 10 A EAV 503028.4 0.0 0.0 503028.4 506128.4 0.000 FIXEDHF 1.000 0 -3100.0 0 2p6 13s 11 B EAV 506369.6 0.0 0.0 506369.6 509469.6 0.000 FIXEDHF 1.000 0 -3100.0 0 2p6 14s 12 C EAV 508984.6 0.0 0.0 508984.6 512084.6 0.000 FIXEDHF 1.000 0 -3100.0 0 2p6 3d 13 D EAV 206557.5 1.0 0.0 206557.5 205884.1 0.000 1.000 0 -3100.0 0 14 D ZETA 5 4.1 0.0 0.0 4.1 13.7 0.300 FIXED 1.000 0 0.0 0 2p6 4d 15 E EAV 345452.5 1.0 0.0 345452.5 348466.1 0.000 1.000 0 -3100.0 0 16 E ZETA 5 2.1 0.8 0.0 2.1 6.4 0.323 1.000 0 0.0 0 2p6 5d 17 F EAV 410659.3 1.0 0.0 410659.3 413758.4 0.000 1.000 0 -3100.0 0 18 F ZETA 5 1.3 0.8 0.0 1.3 3.3 0.383 1.000 0 0.0 0 2p6 6d 19 G EAV 445850.5 1.0 0.0 445850.5 448954.8 0.000 1.000 0 -3100.0 0 20 G ZETA 5 1.9 0.0 0.0 1.9 1.9 1.000 FIXEDHF 1.000 0 0.0 0 2p6 7d 21 H EAV 466943.0 1.0 0.0 466943.0 470044.3 0.000 1.000 0 -3100.0 0 22 H ZETA 5 1.2 0.0 0.0 1.2 1.2 1.000 FIXEDHF 1.000 0 0.0 0 2p6 8d 23 I EAV 480564.5 1.0 0.0 480564.5 483664.7 0.000 1.000 0 -3100.0 0 24 I ZETA 5 0.8 0.0 0.0 0.8 0.8 1.000 FIXEDHF 1.000 0 0.0 0 2p6 9d 25 J EAV 489864.4 0.0 0.0 489864.4 492964.4 0.000 FIXEDHF 1.000 0 -3100.0 0 26 J ZETA 5 0.6 0.0 0.0 0.6 0.6 1.000 FIXEDHF 1.000 0 0.0 0 2p6 10d 27 K EAV 496495.3 0.0 0.0 496495.3 499595.3 0.000 FIXEDHF 1.000 0 -3100.0 0 28 K ZETA 5 0.4 0.0 0.0 0.4 0.4 1.000 FIXEDHF 1.000 0 0.0 0 2p6 11d 29 L EAV 501389.6 0.0 0.0 501389.6 504489.6 0.000 FIXEDHF 1.000 0 -3100.0 0 30 L ZETA 5 0.3 0.0 0.0 0.3 0.3 1.000 FIXEDHF 1.000 0 0.0 0 2p6 12d 31 M EAV 505101.1 0.0 0.0 505101.1 508201.1 0.000 FIXEDHF 1.000 0 -3100.0 0 32 M ZETA 5 0.2 0.0 0.0 0.2 0.2 1.000 FIXEDHF 1.000 0 0.0 0 2p6 13d 33 N EAV 507985.8 0.0 0.0 507985.8 511085.8 0.000 FIXEDHF 1.000 0 -3100.0 0 34 N ZETA 5 0.2 0.0 0.0 0.2 0.2 1.000 FIXEDHF 1.000 0 0.0 0 2p6 14d 35 O EAV 510271.2 0.0 0.0 510271.2 513371.2 0.000 FIXEDHF 1.000 0 -3100.0 0 36 O ZETA 5 0.2 0.0 0.0 0.2 0.2 1.000 FIXEDHF 1.000 0 0.0 0 2p6 5g 37 P EAV 414686.9 1.0 0.0 414686.9 417743.4 0.000 1.000 0 -3100.0 0 38 P ZETA 6 0.4 0.0 0.0 0.4 0.4 1.000 FIXEDHF 1.000 0 0.0 0 2p6 6g 39 Q EAV 448230.4 1.0 0.0 448230.4 451288.6 0.000 1.000 0 -3100.0 0 40 Q ZETA 6 0.3 0.0 0.0 0.3 0.3 1.000 FIXEDHF 1.000 0 0.0 0 2p6 7g 41 R EAV 468456.3 1.0 0.0 468456.3 471524.9 0.000 1.000 0 -3100.0 0 42 R ZETA 6 0.2 0.0 0.0 0.2 0.2 1.000 FIXEDHF 1.000 0 0.0 0 2p6 8g 43 S EAV 481584.3 1.0 0.0 481584.3 484661.0 0.000 1.000 0 -3100.0 0 44 S ZETA 6 0.1 0.0 0.0 0.1 0.1 1.000 FIXEDHF 1.000 0 0.0 0 2p6 9g 45 T EAV 490584.7 1.0 0.0 490584.7 493666.5 0.000 1.000 0 -3100.0 0 46 T ZETA 6 0.1 0.0 0.0 0.1 0.1 1.000 FIXEDHF 1.000 0 0.0 0 2p6 10g 47 U EAV 497008.5 0.0 0.0 497008.5 500108.5 0.000 FIXEDHF 1.000 0 -3100.0 0 48 U ZETA 6 0.1 0.0 0.0 0.1 0.1 1.000 FIXEDHF 1.000 0 0.0 0 2p6 11g 49 V EAV 501775.2 0.0 0.0 501775.2 504875.2 0.000 FIXEDHF 1.000 0 -3100.0 0 50 V ZETA 6 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 12g 51 W EAV 505398.3 0.0 0.0 505398.3 508498.3 0.000 FIXEDHF 1.000 0 -3100.0 0 52 W ZETA 6 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 13g 53 X EAV 508219.8 0.0 0.0 508219.8 511319.8 0.000 FIXEDHF 1.000 0 -3100.0 0 54 X ZETA 6 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 14g 55 Y EAV 510458.5 0.0 0.0 510458.5 513558.5 0.000 FIXEDHF 1.000 0 -3100.0 0 56 Y ZETA 6 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 7i 57 Z EAV 468474.8 1.0 0.0 468474.8 471572.9 0.000 1.000 0 -3100.0 0 58 Z ZETA 7 0.1 0.0 0.0 0.1 0.1 1.000 FIXEDHF 1.000 0 0.0 0 2p6 8i 59 a EAV 481593.3 1.0 0.0 481593.3 484694.9 0.000 1.000 0 -3100.0 0 60 a ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 9i 61 b EAV 490592.1 0.0 0.0 490592.1 493692.1 0.000 FIXEDHF 1.000 0 -3100.0 0 62 b ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 10i 63 c EAV 497027.3 0.0 0.0 497027.3 500127.3 0.000 FIXEDHF 1.000 0 -3100.0 0 64 c ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 11i 65 d EAV 501788.2 0.0 0.0 501788.2 504888.2 0.000 FIXEDHF 1.000 0 -3100.0 0 66 d ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 12i 67 e EAV 505409.7 0.0 0.0 505409.7 508509.7 0.000 FIXEDHF 1.000 0 -3100.0 0 68 e ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 13i 69 f EAV 508229.2 0.0 0.0 508229.2 511329.2 0.000 FIXEDHF 1.000 0 -3100.0 0 70 f ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p6 14i 71 g EAV 510464.8 0.0 0.0 510464.8 513564.8 0.000 FIXEDHF 1.000 0 -3100.0 0 72 g ZETA 7 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 1.000 0 0.0 0 2p5 3s3p 73 h EAV 1132197.4 0.0 0.0 1132197.4 1135297.4 0.000 FIXEDHF 1.000 0 -3100.0 0 74 h ZETA 1 4880.8 0.0 0.0 4880.8 4880.8 1.000 FIXEDHF 1.000 0 0.0 0 75 h ZETA 3 653.6 0.0 0.0 653.6 653.6 1.000 FIXEDHF 1.000 0 0.0 0 76 h F2(13) 26822.0 0.0 0.0 26822.0 33527.5 0.800 FIXEDHF 0.800 0 0.0 0 77 h G1(12) 12359.9 0.0 0.0 12359.9 15449.9 0.800 FIXEDHF 0.800 0 0.0 0 78 h G0(13) 12729.2 0.0 0.0 12729.2 15911.5 0.800 FIXEDHF 0.800 0 0.0 0 79 h G2(13) 11868.7 0.0 0.0 11868.7 14835.9 0.800 FIXEDHF 0.800 0 0.0 0 80 h G1(23) 67463.6 0.0 0.0 67463.6 84329.5 0.800 FIXEDHF 0.800 0 0.0 0 2p5 3p3d 81 i EAV 1356211.8 0.0 0.0 1356211.8 1359311.8 0.000 FIXEDHF 1.000 0 -3100.0 0 82 i ZETA 1 4906.0 0.0 0.0 4906.0 4906.0 1.000 FIXEDHF 1.000 0 0.0 0 83 i ZETA 3 660.2 0.0 0.0 660.2 660.2 1.000 FIXEDHF 1.000 0 0.0 0 84 i ZETA 5 23.7 0.0 0.0 23.7 23.7 1.000 FIXEDHF 1.000 0 0.0 0 85 i F2(13) 26970.2 0.0 0.0 26970.2 33712.7 0.800 FIXEDHF 0.800 0 0.0 0 86 i F2(15) 22399.0 0.0 0.0 22399.0 27998.8 0.800 FIXEDHF 0.800 0 0.0 0 87 i F2(35) 47800.2 0.0 0.0 47800.2 59750.2 0.800 FIXEDHF 0.800 0 0.0 0 88 i G0(13) 12760.4 0.0 0.0 12760.4 15950.5 0.800 FIXEDHF 0.800 0 0.0 0 89 i G2(13) 11925.2 0.0 0.0 11925.2 14906.5 0.800 FIXEDHF 0.800 0 0.0 0 90 i G1(15) 15120.2 0.0 0.0 15120.2 18900.3 0.800 FIXEDHF 0.800 0 0.0 0 91 i G3(15) 8571.5 0.0 0.0 8571.5 10714.4 0.800 FIXEDHF 0.800 0 0.0 0 92 i G1(35) 58596.2 0.0 0.0 58596.2 73245.3 0.800 FIXEDHF 0.800 0 0.0 0 93 i G3(35) 36788.0 0.0 0.0 36788.0 45985.0 0.800 FIXEDHF 0.800 0 0.0 0 2p6 3s -2p5 3s3p 94 1h 0D1113 6515.0 0.0 0.0 6515.0 8143.7 0.800 FIXEDHF 0.800 0 0.0 0 95 1h 2D1113 29041.3 0.0 0.0 29041.3 36301.6 0.800 FIXEDHF 0.800 0 0.0 0 96 1h 1D1223 -6055.1 0.0 0.0 -6055.1 -7568.9 0.800 FIXEDHF 0.800 0 0.0 0 97 1h 0E1223 -883.9 0.0 0.0 -883.9 -1104.9 0.800 FIXEDHF 0.800 0 0.0 0 2p6 3s -2p5 3p3d 98 1i 2D1235 -9700.5 0.0 0.0 -9700.5 -12125.6 0.800 FIXEDHF 0.800 0 0.0 0 99 1i 1E1235 -23329.0 0.0 0.0 -23329.0 -29161.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 4s -2p5 3s3p 100 2h 1D1423 -120.6 0.0 0.0 -120.6 -150.8 0.800 FIXEDHF 0.800 0 0.0 0 101 2h 0E1423 2793.6 0.0 0.0 2793.6 3492.0 0.800 FIXEDHF 0.800 0 0.0 0 2p6 4s -2p5 3p3d 102 2i 2D1435 -2954.1 0.0 0.0 -2954.1 -3692.6 0.800 FIXEDHF 0.800 0 0.0 0 103 2i 1E1435 -6771.3 0.0 0.0 -6771.3 -8464.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 5s -2p5 3s3p 104 3h 1D1423 256.0 0.0 0.0 256.0 320.0 0.800 FIXEDHF 0.800 0 0.0 0 105 3h 0E1423 1837.7 0.0 0.0 1837.7 2297.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 5s -2p5 3p3d 106 3i 2D1435 -1669.9 0.0 0.0 -1669.9 -2087.4 0.800 FIXEDHF 0.800 0 0.0 0 107 3i 1E1435 -3814.1 0.0 0.0 -3814.1 -4767.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 6s -2p5 3s3p 108 4h 1D1423 280.8 0.0 0.0 280.8 351.0 0.800 FIXEDHF 0.800 0 0.0 0 109 4h 0E1423 1328.3 0.0 0.0 1328.3 1660.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 6s -2p5 3p3d 110 4i 2D1435 -1126.6 0.0 0.0 -1126.6 -1408.2 0.800 FIXEDHF 0.800 0 0.0 0 111 4i 1E1435 -2575.9 0.0 0.0 -2575.9 -3219.9 0.800 FIXEDHF 0.800 0 0.0 0 2p6 7s -2p5 3s3p 112 5h 1D1423 252.9 0.0 0.0 252.9 316.1 0.800 FIXEDHF 0.800 0 0.0 0 113 5h 0E1423 1018.7 0.0 0.0 1018.7 1273.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 7s -2p5 3p3d 114 5i 2D1435 -832.0 0.0 0.0 -832.0 -1040.0 0.800 FIXEDHF 0.800 0 0.0 0 115 5i 1E1435 -1904.9 0.0 0.0 -1904.9 -2381.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 8s -2p5 3s3p 116 6h 1D1423 219.6 0.0 0.0 219.6 274.5 0.800 FIXEDHF 0.800 0 0.0 0 117 6h 0E1423 813.8 0.0 0.0 813.8 1017.2 0.800 FIXEDHF 0.800 0 0.0 0 2p6 8s -2p5 3p3d 118 6i 2D1435 -649.4 0.0 0.0 -649.4 -811.8 0.800 FIXEDHF 0.800 0 0.0 0 119 6i 1E1435 -1488.5 0.0 0.0 -1488.5 -1860.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 9s -2p5 3s3p 120 7h 1D1423 190.0 0.0 0.0 190.0 237.5 0.800 FIXEDHF 0.800 0 0.0 0 121 7h 0E1423 669.5 0.0 0.0 669.5 836.9 0.800 FIXEDHF 0.800 0 0.0 0 2p6 9s -2p5 3p3d 122 7i 2D1435 -526.4 0.0 0.0 -526.4 -658.0 0.800 FIXEDHF 0.800 0 0.0 0 123 7i 1E1435 -1207.3 0.0 0.0 -1207.3 -1509.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 10s -2p5 3s3p 124 8h 1D1423 165.3 0.0 0.0 165.3 206.6 0.800 FIXEDHF 0.800 0 0.0 0 125 8h 0E1423 563.6 0.0 0.0 563.6 704.5 0.800 FIXEDHF 0.800 0 0.0 0 2p6 10s -2p5 3p3d 126 8i 2D1435 -438.5 0.0 0.0 -438.5 -548.1 0.800 FIXEDHF 0.800 0 0.0 0 127 8i 1E1435 -1006.2 0.0 0.0 -1006.2 -1257.7 0.800 FIXEDHF 0.800 0 0.0 0 2p6 11s -2p5 3s3p 128 9h 1D1423 145.0 0.0 0.0 145.0 181.2 0.800 FIXEDHF 0.800 0 0.0 0 129 9h 0E1423 483.0 0.0 0.0 483.0 603.7 0.800 FIXEDHF 0.800 0 0.0 0 2p6 11s -2p5 3p3d 130 9i 2D1435 -372.9 0.0 0.0 -372.9 -466.1 0.800 FIXEDHF 0.800 0 0.0 0 131 9i 1E1435 -856.1 0.0 0.0 -856.1 -1070.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 12s -2p5 3s3p 132 Ah 1D1423 128.2 0.0 0.0 128.2 160.2 0.800 FIXEDHF 0.800 0 0.0 0 133 Ah 0E1423 419.9 0.0 0.0 419.9 524.9 0.800 FIXEDHF 0.800 0 0.0 0 2p6 12s -2p5 3p3d 134 Ai 2D1435 -322.4 0.0 0.0 -322.4 -403.0 0.800 FIXEDHF 0.800 0 0.0 0 135 Ai 1E1435 -740.4 0.0 0.0 -740.4 -925.5 0.800 FIXEDHF 0.800 0 0.0 0 2p6 13s -2p5 3s3p 136 Bh 1D1423 114.2 0.0 0.0 114.2 142.8 0.800 FIXEDHF 0.800 0 0.0 0 137 Bh 0E1423 369.5 0.0 0.0 369.5 461.9 0.800 FIXEDHF 0.800 0 0.0 0 2p6 13s -2p5 3p3d 138 Bi 2D1435 -282.5 0.0 0.0 -282.5 -353.1 0.800 FIXEDHF 0.800 0 0.0 0 139 Bi 1E1435 -648.9 0.0 0.0 -648.9 -811.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 14s -2p5 3s3p 140 Ch 1D1423 102.5 0.0 0.0 102.5 128.1 0.800 FIXEDHF 0.800 0 0.0 0 141 Ch 0E1423 328.5 0.0 0.0 328.5 410.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 14s -2p5 3p3d 142 Ci 2D1435 -250.2 0.0 0.0 -250.2 -312.8 0.800 FIXEDHF 0.800 0 0.0 0 143 Ci 1E1435 -575.0 0.0 0.0 -575.0 -718.7 0.800 FIXEDHF 0.800 0 0.0 0 2p6 3d -2p5 3s3p 144 Dh 1D1523 -8816.8 0.0 0.0 -8816.8 -11021.0 0.800 FIXEDHF 0.800 0 0.0 0 145 Dh 2E1523 -8961.6 0.0 0.0 -8961.6 -11202.0 0.800 FIXEDHF 0.800 0 0.0 0 2p6 3d -2p5 3p3d 146 Di 0D1113 6523.9 0.0 0.0 6523.9 8154.9 0.800 FIXEDHF 0.800 0 0.0 0 147 Di 2D1113 29113.4 0.0 0.0 29113.4 36391.7 0.800 FIXEDHF 0.800 0 0.0 0 148 Di 0D1535 -1526.2 0.0 0.0 -1526.2 -1907.7 0.800 FIXEDHF 0.800 0 0.0 0 149 Di 2D1535 -7628.0 0.0 0.0 -7628.0 -9535.0 0.800 FIXEDHF 0.800 0 0.0 0 150 Di 1E1535 -18534.8 0.0 0.0 -18534.8 -23168.5 0.800 FIXEDHF 0.800 0 0.0 0 151 Di 3E1535 -8305.1 0.0 0.0 -8305.1 -10381.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 4d -2p5 3s3p 152 Eh 1D1523 -3463.4 0.0 0.0 -3463.4 -4329.3 0.800 FIXEDHF 0.800 0 0.0 0 153 Eh 2E1523 -4275.2 0.0 0.0 -4275.2 -5344.0 0.800 FIXEDHF 0.800 0 0.0 0 2p6 4d -2p5 3p3d 154 Ei 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 155 Ei 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 156 Ei 0D1535 1508.3 0.0 0.0 1508.3 1885.4 0.800 FIXEDHF 0.800 0 0.0 0 157 Ei 2D1535 -3124.5 0.0 0.0 -3124.5 -3905.6 0.800 FIXEDHF 0.800 0 0.0 0 158 Ei 1E1535 -7350.6 0.0 0.0 -7350.6 -9188.2 0.800 FIXEDHF 0.800 0 0.0 0 159 Ei 3E1535 -4076.1 0.0 0.0 -4076.1 -5095.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 5d -2p5 3s3p 160 Fh 1D1523 -1948.6 0.0 0.0 -1948.6 -2435.8 0.800 FIXEDHF 0.800 0 0.0 0 161 Fh 2E1523 -2589.5 0.0 0.0 -2589.5 -3236.9 0.800 FIXEDHF 0.800 0 0.0 0 2p6 5d -2p5 3p3d 162 Fi 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 163 Fi 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 164 Fi 0D1535 1074.6 0.0 0.0 1074.6 1343.2 0.800 FIXEDHF 0.800 0 0.0 0 165 Fi 2D1535 -1768.1 0.0 0.0 -1768.1 -2210.1 0.800 FIXEDHF 0.800 0 0.0 0 166 Fi 1E1535 -4101.8 0.0 0.0 -4101.8 -5127.2 0.800 FIXEDHF 0.800 0 0.0 0 167 Fi 3E1535 -2483.5 0.0 0.0 -2483.5 -3104.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 6d -2p5 3s3p 168 Gh 1D1523 -1297.8 0.0 0.0 -1297.8 -1622.2 0.800 FIXEDHF 0.800 0 0.0 0 169 Gh 2E1523 -1790.6 0.0 0.0 -1790.6 -2238.2 0.800 FIXEDHF 0.800 0 0.0 0 2p6 6d -2p5 3p3d 170 Gi 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 171 Gi 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 172 Gi 0D1535 810.2 0.0 0.0 810.2 1012.8 0.800 FIXEDHF 0.800 0 0.0 0 173 Gi 2D1535 -1174.8 0.0 0.0 -1174.8 -1468.5 0.800 FIXEDHF 0.800 0 0.0 0 174 Gi 1E1535 -2706.5 0.0 0.0 -2706.5 -3383.1 0.800 FIXEDHF 0.800 0 0.0 0 175 Gi 3E1535 -1718.6 0.0 0.0 -1718.6 -2148.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 7d -2p5 3s3p 176 Hh 1D1523 -949.7 0.0 0.0 -949.7 -1187.1 0.800 FIXEDHF 0.800 0 0.0 0 177 Hh 2E1523 -1339.3 0.0 0.0 -1339.3 -1674.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 7d -2p5 3p3d 178 Hi 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 179 Hi 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 180 Hi 0D1535 638.2 0.0 0.0 638.2 797.8 0.800 FIXEDHF 0.800 0 0.0 0 181 Hi 2D1535 -856.6 0.0 0.0 -856.6 -1070.7 0.800 FIXEDHF 0.800 0 0.0 0 182 Hi 1E1535 -1965.5 0.0 0.0 -1965.5 -2456.9 0.800 FIXEDHF 0.800 0 0.0 0 183 Hi 3E1535 -1285.0 0.0 0.0 -1285.0 -1606.2 0.800 FIXEDHF 0.800 0 0.0 0 2p6 8d -2p5 3s3p 184 Ih 1D1523 -737.1 0.0 0.0 -737.1 -921.4 0.800 FIXEDHF 0.800 0 0.0 0 185 Ih 2E1523 -1054.2 0.0 0.0 -1054.2 -1317.7 0.800 FIXEDHF 0.800 0 0.0 0 2p6 8d -2p5 3p3d 186 Ii 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 187 Ii 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 188 Ii 0D1535 519.4 0.0 0.0 519.4 649.3 0.800 FIXEDHF 0.800 0 0.0 0 189 Ii 2D1535 -662.6 0.0 0.0 -662.6 -828.3 0.800 FIXEDHF 0.800 0 0.0 0 190 Ii 1E1535 -1516.7 0.0 0.0 -1516.7 -1895.9 0.800 FIXEDHF 0.800 0 0.0 0 191 Ii 3E1535 -1010.6 0.0 0.0 -1010.6 -1263.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 9d -2p5 3s3p 192 Jh 1D1523 -595.4 0.0 0.0 -595.4 -744.3 0.800 FIXEDHF 0.800 0 0.0 0 193 Jh 2E1523 -859.6 0.0 0.0 -859.6 -1074.5 0.800 FIXEDHF 0.800 0 0.0 0 2p6 9d -2p5 3p3d 194 Ji 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 195 Ji 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 196 Ji 0D1535 433.4 0.0 0.0 433.4 541.7 0.800 FIXEDHF 0.800 0 0.0 0 197 Ji 2D1535 -533.8 0.0 0.0 -533.8 -667.2 0.800 FIXEDHF 0.800 0 0.0 0 198 Ji 1E1535 -1219.8 0.0 0.0 -1219.8 -1524.7 0.800 FIXEDHF 0.800 0 0.0 0 199 Ji 3E1535 -823.7 0.0 0.0 -823.7 -1029.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 10d -2p5 3s3p 200 Kh 1D1523 -495.0 0.0 0.0 -495.0 -618.8 0.800 FIXEDHF 0.800 0 0.0 0 201 Kh 2E1523 -719.5 0.0 0.0 -719.5 -899.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 10d -2p5 3p3d 202 Ki 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 203 Ki 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 204 Ki 0D1535 368.7 0.0 0.0 368.7 460.9 0.800 FIXEDHF 0.800 0 0.0 0 205 Ki 2D1535 -442.8 0.0 0.0 -442.8 -553.5 0.800 FIXEDHF 0.800 0 0.0 0 206 Ki 1E1535 -1010.6 0.0 0.0 -1010.6 -1263.3 0.800 FIXEDHF 0.800 0 0.0 0 207 Ki 3E1535 -689.0 0.0 0.0 -689.0 -861.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 11d -2p5 3s3p 208 Lh 1D1523 -420.6 0.0 0.0 -420.6 -525.8 0.800 FIXEDHF 0.800 0 0.0 0 209 Lh 2E1523 -614.5 0.0 0.0 -614.5 -768.1 0.800 FIXEDHF 0.800 0 0.0 0 2p6 11d -2p5 3p3d 210 Li 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 211 Li 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 212 Li 0D1535 318.7 0.0 0.0 318.7 398.4 0.800 FIXEDHF 0.800 0 0.0 0 213 Li 2D1535 -375.6 0.0 0.0 -375.6 -469.5 0.800 FIXEDHF 0.800 0 0.0 0 214 Li 1E1535 -856.5 0.0 0.0 -856.5 -1070.6 0.800 FIXEDHF 0.800 0 0.0 0 215 Li 3E1535 -588.2 0.0 0.0 -588.2 -735.2 0.800 FIXEDHF 0.800 0 0.0 0 2p6 12d -2p5 3s3p 216 Mh 1D1523 -363.6 0.0 0.0 -363.6 -454.5 0.800 FIXEDHF 0.800 0 0.0 0 217 Mh 2E1523 -533.1 0.0 0.0 -533.1 -666.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 12d -2p5 3p3d 218 Mi 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 219 Mi 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 220 Mi 0D1535 279.0 0.0 0.0 279.0 348.8 0.800 FIXEDHF 0.800 0 0.0 0 221 Mi 2D1535 -324.2 0.0 0.0 -324.2 -405.2 0.800 FIXEDHF 0.800 0 0.0 0 222 Mi 1E1535 -738.7 0.0 0.0 -738.7 -923.4 0.800 FIXEDHF 0.800 0 0.0 0 223 Mi 3E1535 -510.1 0.0 0.0 -510.1 -637.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 13d -2p5 3s3p 224 Nh 1D1523 -318.6 0.0 0.0 -318.6 -398.2 0.800 FIXEDHF 0.800 0 0.0 0 225 Nh 2E1523 -468.5 0.0 0.0 -468.5 -585.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 13d -2p5 3p3d 226 Ni 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 227 Ni 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 228 Ni 0D1535 247.0 0.0 0.0 247.0 308.7 0.800 FIXEDHF 0.800 0 0.0 0 229 Ni 2D1535 -283.7 0.0 0.0 -283.7 -354.6 0.800 FIXEDHF 0.800 0 0.0 0 230 Ni 1E1535 -646.2 0.0 0.0 -646.2 -807.7 0.800 FIXEDHF 0.800 0 0.0 0 231 Ni 3E1535 -448.2 0.0 0.0 -448.2 -560.2 0.800 FIXEDHF 0.800 0 0.0 0 2p6 14d -2p5 3s3p 232 Oh 1D1523 -282.3 0.0 0.0 -282.3 -352.9 0.800 FIXEDHF 0.800 0 0.0 0 233 Oh 2E1523 -416.2 0.0 0.0 -416.2 -520.2 0.800 FIXEDHF 0.800 0 0.0 0 2p6 14d -2p5 3p3d 234 Oi 0D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 235 Oi 2D1113 0.0 0.0 0.0 0.0 0.0 0.000 FIXEDHF 0.800 0 0.0 0 236 Oi 0D1535 220.6 0.0 0.0 220.6 275.8 0.800 FIXEDHF 0.800 0 0.0 0 237 Oi 2D1535 -251.2 0.0 0.0 -251.2 -314.0 0.800 FIXEDHF 0.800 0 0.0 0 238 Oi 1E1535 -571.8 0.0 0.0 -571.8 -714.8 0.800 FIXEDHF 0.800 0 0.0 0 239 Oi 3E1535 -398.0 0.0 0.0 -398.0 -497.5 0.800 FIXEDHF 0.800 0 0.0 0 2p6 5g -2p5 3p3d 240 Pi 2D1635 -651.4 0.0 0.0 -651.4 -814.3 0.800 FIXEDHF 0.800 0 0.0 0 241 Pi 3E1635 -478.6 0.0 0.0 -478.6 -598.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 6g -2p5 3p3d 242 Qi 2D1635 -619.4 0.0 0.0 -619.4 -774.3 0.800 FIXEDHF 0.800 0 0.0 0 243 Qi 3E1635 -472.8 0.0 0.0 -472.8 -591.0 0.800 FIXEDHF 0.800 0 0.0 0 2p6 7g -2p5 3p3d 244 Ri 2D1635 -541.6 0.0 0.0 -541.6 -677.0 0.800 FIXEDHF 0.800 0 0.0 0 245 Ri 3E1635 -422.2 0.0 0.0 -422.2 -527.7 0.800 FIXEDHF 0.800 0 0.0 0 2p6 8g -2p5 3p3d 246 Si 2D1635 -467.6 0.0 0.0 -467.6 -584.5 0.800 FIXEDHF 0.800 0 0.0 0 247 Si 3E1635 -369.2 0.0 0.0 -369.2 -461.5 0.800 FIXEDHF 0.800 0 0.0 0 2p6 9g -2p5 3p3d 248 Ti 2D1635 -405.2 0.0 0.0 -405.2 -506.5 0.800 FIXEDHF 0.800 0 0.0 0 249 Ti 3E1635 -322.6 0.0 0.0 -322.6 -403.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 10g -2p5 3p3d 250 Ui 2D1635 -353.8 0.0 0.0 -353.8 -442.2 0.800 FIXEDHF 0.800 0 0.0 0 251 Ui 3E1635 -283.4 0.0 0.0 -283.4 -354.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 11g -2p5 3p3d 252 Vi 2D1635 -311.5 0.0 0.0 -311.5 -389.4 0.800 FIXEDHF 0.800 0 0.0 0 253 Vi 3E1635 -250.7 0.0 0.0 -250.7 -313.4 0.800 FIXEDHF 0.800 0 0.0 0 2p6 12g -2p5 3p3d 254 Wi 2D1635 -276.6 0.0 0.0 -276.6 -345.8 0.800 FIXEDHF 0.800 0 0.0 0 255 Wi 3E1635 -223.4 0.0 0.0 -223.4 -279.3 0.800 FIXEDHF 0.800 0 0.0 0 2p6 13g -2p5 3p3d 256 Xi 2D1635 -247.6 0.0 0.0 -247.6 -309.5 0.800 FIXEDHF 0.800 0 0.0 0 257 Xi 3E1635 -200.5 0.0 0.0 -200.5 -250.6 0.800 FIXEDHF 0.800 0 0.0 0 2p6 14g -2p5 3p3d 258 Yi 2D1635 -223.1 0.0 0.0 -223.1 -278.9 0.800 FIXEDHF 0.800 0 0.0 0 259 Yi 3E1635 -181.0 0.0 0.0 -181.0 -226.3 0.800 FIXEDHF 0.800 0 0.0 0 2p5 3s3p -2p5 3p3d 260 hi 2D1215 11209.7 0.0 0.0 11209.7 14012.1 0.800 FIXEDHF 0.800 0 0.0 0 261 hi 1E1215 -3769.4 0.0 0.0 -3769.4 -4711.7 0.800 FIXEDHF 0.800 0 0.0 0 262 hi 1D2335 61890.4 0.0 0.0 61890.4 77363.0 0.800 FIXEDHF 0.800 0 0.0 0 263 hi 2E2335 47267.4 0.0 0.0 47267.4 59084.2 0.800 FIXEDHF 0.800 0 0.0 0 STANDARD DEVIATION 1.5 22 FREE ITERATION 1 KURUCZ job terminated at 18-AUG-2016 19:43:35.24 Accounting information: Buffered I/O count: 172 Peak working set size: 9712 Direct I/O count: 332 Peak virtual size: 322592 Page faults: 2086 Mounted volumes: 0 Charged CPU time: 0 00:00:00.20 Elapsed time: 0 00:00:03.61