$SETPOOL $SET VERIFY=NOIMAGE $ASSIGN POOLQ:GAq2101E.LIN FOR007 $ASSIGN POOLQ:GAq2101E.WNLIN FOR027 $ASSIGN 2101:GAq2101E.GAM FOR008 $ASSIGN SYS$OUTPUT FOR009 $ASSIGN K4B:C2101E.EIG FOR002 $ASSIGN K4E:C2101E.EIG FOR003 $ASSIGN 2101:RRHF2101E.DAT FOR012 $ASSIGN POOL:GAq210115.DAT FOR015 $ASSIGN 2101:LSQ2101E.DAT FOR041 $RUN CRAY:BIGGFQ3007 21.01 EVE 0. 100000. -7.5 103237. 90000. 90000. 1. 99. WAVELO WAVEHI GALO EION EGALO EBOLT STARTJJ STOPJJ 1 1 (4s )3d4s (4s )3d4s -2.83620 1 12 (4s )3d4s (4s )4s2 -3.54841 1 13 (4s )3d4s (4s )4s5s 0.99657 1 23 (3d )3d4s (3d )3d2 -5.87133 1 24 (3d )3d4s (3d )3d4d 13.25164 1 25 (3d )3d4s (3d )3d5d 3.62715 1 26 (3d )3d4s (3d )3d6d 1.44888 1 35 (4s )3d4s (4s )4s4d +3.58894 2 2 (5s )3d5s (5s )3d5s -2.24713 2 13 (5s )3d5s (5s )4s5s -2.68208 2 23 (3d )3d5s (3d )3d2 2.27782 2 24 (3d )3d5s (3d )3d4d -50.45228 2 25 (3d )3d5s (3d )3d5d 47.50807 2 26 (3d )3d5s (3d )3d6d 12.86174 3 3 (6s )3d6s (6s )3d6s -2.05999 3 23 (3d )3d6s (3d )3d2 0.71171 3 24 (3d )3d6s (3d )3d4d 26.43028 3 25 (3d )3d6s (3d )3d5d -162.10354 3 26 (3d )3d6s (3d )3d6d 118.23184 4 4 (7s )3d7s (7s )3d7s -1.97385 4 23 (3d )3d7s (3d )3d2 0.41712 4 24 (3d )3d7s (3d )3d4d 5.69497 4 25 (3d )3d7s (3d )3d5d 93.36109 4 26 (3d )3d7s (3d )3d6d -382.92707 12 1 (4s )4s2 (4s )3d4s -3.54841 12 35 (4s )4s2 (4s )4s4d 12.37554 13 1 (4s )4s5s (4s )3d4s 0.99657 13 2 (5s )4s5s (5s )3d5s -2.68208 13 35 (4s )4s5s (4s )4s4d -35.87775 23 1 (3d )3d2 (3d )3d4s -5.87133 23 2 (3d )3d2 (3d )3d5s 2.27782 23 3 (3d )3d2 (3d )3d6s 0.71171 23 4 (3d )3d2 (3d )3d7s 0.41712 23 23 (3d )3d2 (3d )3d2 -4.68235 23 24 (3d )3d2 (3d )3d4d +5.61565 23 25 (3d )3d2 (3d )3d5d +1.87375 23 26 (3d )3d2 (3d )3d6d +0.96651 23 50 (3d )3d2 (3d )3d5g 5.40416 24 1 (3d )3d4d (3d )3d4s 13.25164 24 2 (3d )3d4d (3d )3d5s -50.45228 24 3 (3d )3d4d (3d )3d6s 26.43028 24 4 (3d )3d4d (3d )3d7s 5.69497 24 23 (3d )3d4d (3d )3d2 +5.61565 24 24 (3d+4d )3d4d (3d+4d )3d4d -58.84432 24 25 (3d )3d4d (3d )3d5d +42.03198 24 26 (3d )3d4d (3d )3d6d +9.80641 24 35 (4d )3d4d (4d )4s4d -2.82740 24 50 (3d )3d4d (3d )3d5g -86.00793 25 1 (3d )3d5d (3d )3d4s 3.62715 25 2 (3d )3d5d (3d )3d5s 47.50807 25 3 (3d )3d5d (3d )3d6s -162.10354 25 4 (3d )3d5d (3d )3d7s 93.36109 25 23 (3d )3d5d (3d )3d2 +1.87375 25 24 (3d )3d5d (3d )3d4d +42.03198 25 25 (3d+5d )3d5d (3d+5d )3d5d -189.89766 25 26 (3d )3d5d (3d )3d6d +118.16158 25 50 (3d )3d5d (3d )3d5g 228.46653 26 1 (3d )3d6d (3d )3d4s 1.44888 26 2 (3d )3d6d (3d )3d5s 12.86174 26 3 (3d )3d6d (3d )3d6s 118.23184 26 4 (3d )3d6d (3d )3d7s -382.92707 26 23 (3d )3d6d (3d )3d2 +0.96651 26 24 (3d )3d6d (3d )3d4d +9.80641 26 25 (3d )3d6d (3d )3d5d +118.16158 26 26 (3d+6d )3d6d (3d+6d )3d6d -461.65272 26 50 (3d )3d6d (3d )3d5g -185.06787 35 1 (4s )4s4d (4s )3d4s +3.58894 35 12 (4s )4s4d (4s )4s2 12.37554 35 13 (4s )4s4d (4s )4s5s -35.87775 35 24 (4d )4s4d (4d )3d4d -2.82740 35 35 (4s )4s4d (4s )4s4d -38.37400 50 23 (3d )3d5g (3d )3d2 5.40416 50 24 (3d )3d5g (3d )3d4d -86.00793 50 25 (3d )3d5g (3d )3d5d 228.46653 50 26 (3d )3d5g (3d )3d6d -185.06787 50 50 (3d+5g )3d5g (3d+5g )3d5g -228.29473 61 61 (4p )4p2 (4p )4p2 -14.89121 0 $ASSIGN K1B: SORTWORK0 $ASSIGN K1B: SORTWORK1 $SORT/STAT POOLQ:GAq2101E.LIN POOLQ:GAq2101E.LIN $SORT/STAT POOLQ:GAq2101E.WNLIN POOLQ:GAq2101E.WNLIN