BARIUM   [XE]6S(2), 1S
      CHARGE = 56.000000
      SYMMETRY SPECIES               S     P     D
      NUMBER OF BASIS FUNCTIONS     27    23    15
      NUMBER OF CLOSED SHELLS        6     4     2
      NUMBER OF OPEN SHELLS          0     0     0
      OPEN SHELL OCCUPATION NUMBER   0     0     0
  *** FINAL SCF RESULTS ***
   E = -8132.095988033
  ORBITAL ENERGIES AND EXPANSION COEFFICIENTS
        S                    1S             2S             3S             4S             5S             6S
  BASIS/ORB.ENERGY    -1382.7535000   -222.4636900    -48.6344830    -10.2548760     -1.6031313     -0.1630222
   S   2.3173338D+10      0.0000034     -0.0000012      0.0000005      0.0000002      0.0000001      0.0000000
   S   3.5331827D+09      0.0000097     -0.0000034      0.0000015      0.0000007      0.0000003      0.0000001
   S   6.4677280D+08      0.0000314     -0.0000110      0.0000050      0.0000023      0.0000009      0.0000003
   S   1.3583776D+08      0.0000847     -0.0000298      0.0000135      0.0000063      0.0000025      0.0000007
   S   3.4276864D+07      0.0002007     -0.0000705      0.0000319      0.0000149      0.0000058      0.0000016
   S   9.7841927D+06      0.0004547     -0.0001599      0.0000724      0.0000337      0.0000133      0.0000037
   S   2.9828642D+06      0.0010226     -0.0003596      0.0001629      0.0000758      0.0000298      0.0000083
   S   9.5915884D+05      0.0021808     -0.0007700      0.0003486      0.0001623      0.0000639      0.0000178
   S   3.3316130D+05      0.0044768     -0.0015829      0.0007178      0.0003341      0.0001315      0.0000367
   S   1.2145151D+05      0.0093307     -0.0033351      0.0015116      0.0007042      0.0002774      0.0000773
   S   4.5954089D+04      0.0194851     -0.0070031      0.0031872      0.0014838      0.0005839      0.0001629
   S   1.8125830D+04      0.0405662     -0.0149997      0.0068226      0.0031829      0.0012548      0.0003497
   S   7.4396235D+03      0.0848115     -0.0321074      0.0147561      0.0068787      0.0027066      0.0007556
   S   3.1323450D+03      0.1723597     -0.0708399      0.0326808      0.0153072      0.0060419      0.0016831
   S   1.3442693D+03      0.3017715     -0.1388487      0.0660270      0.0309724      0.0121978      0.0034080
   S   5.9189171D+02      0.3499504     -0.2142639      0.1049318      0.0499303      0.0197963      0.0055107
   S   2.6868156D+02      0.1829874     -0.0880096      0.0462494      0.0217596      0.0084941      0.0023987
   S   1.0792889D+02      0.0194710      0.4652013     -0.3572386     -0.1851599     -0.0743695     -0.0208850
   S   4.9008609D+01     -0.0024908      0.6042422     -0.6261918     -0.3595914     -0.1490097     -0.0416653
   S   1.8756479D+01      0.0011707      0.1142647      0.3737260      0.3159423      0.1439724      0.0403672
   S   9.6247157D+00     -0.0007866     -0.0222088      0.8639195      0.9962927      0.4778659      0.1385159
   S   3.5941872D+00      0.0003813      0.0081384      0.1264023     -0.5008852     -0.3426868     -0.1067294
   S   1.8128841D+00     -0.0001996     -0.0042207     -0.0211247     -0.9061840     -0.8400478     -0.2642567
   S   5.0369287D-01      0.0000718      0.0014398      0.0057502     -0.0673444      0.7057616      0.2818283
   S   2.4029736D-01     -0.0000386     -0.0007604     -0.0029957      0.0184677      0.6421780      0.4604226
   S   4.7101954D-02      0.0000106      0.0002093      0.0007851     -0.0040266      0.0228623     -0.6671509
   S   2.0323929D-02     -0.0000049     -0.0000975     -0.0003647      0.0018178     -0.0071080     -0.5397595
        P                    2P             3P             4P             5P
  BASIS/ORB.ENERGY     -199.3878000    -41.0432210     -7.6987291     -0.8990551
   P   5.2412462D+07      0.0000028     -0.0000014     -0.0000006     -0.0000002
   P   7.1721942D+06      0.0000098     -0.0000047     -0.0000021     -0.0000008
   P   1.4897786D+06      0.0000286     -0.0000136     -0.0000062     -0.0000022
   P   3.8042765D+05      0.0000805     -0.0000384     -0.0000175     -0.0000062
   P   1.1266547D+05      0.0002225     -0.0001063     -0.0000484     -0.0000173
   P   3.7747242D+04      0.0006164     -0.0002950     -0.0001344     -0.0000480
   P   1.4038281D+04      0.0017415     -0.0008363     -0.0003810     -0.0001365
   P   5.6846149D+03      0.0050019     -0.0024143     -0.0011015     -0.0003931
   P   2.4756452D+03      0.0142555     -0.0069428     -0.0031716     -0.0011380
   P   1.1421328D+03      0.0390945     -0.0193416     -0.0088709     -0.0031671
   P   5.5305758D+02      0.0962020     -0.0489654     -0.0225735     -0.0081202
   P   2.7937904D+02      0.1976218     -0.1048564     -0.0488206     -0.0174578
   P   1.4542437D+02      0.3116858     -0.1746480     -0.0823091     -0.0298245
   P   7.7342909D+01      0.3210362     -0.1735869     -0.0808590     -0.0285934
   P   4.1441118D+01      0.1710800      0.0396825      0.0398501      0.0149843
   P   2.2071772D+01      0.0326841      0.4017848      0.2709387      0.1066893
   P   1.1968891D+01      0.0013795      0.4811545      0.3725209      0.1433250
   P   6.3973447D+00      0.0000242      0.1843275     -0.0854758     -0.0530308
   P   3.2435863D+00     -0.0001146      0.0166000     -0.6202269     -0.3419842
   P   1.6194795D+00     -0.0000295      0.0008334     -0.4387129     -0.2454973
   P   6.7663659D-01      0.0000005     -0.0000920     -0.0546786      0.4003437
   P   3.0623076D-01     -0.0000006      0.0000282      0.0041344      0.6315272
   P   1.2627262D-01      0.0000002     -0.0000083     -0.0010032      0.1827693
        D                    3D             4D
  BASIS/ORB.ENERGY      -29.9461210     -3.8540696
   D   1.7086789D+04      0.0000232     -0.0000102
   D   3.8927145D+03      0.0002272     -0.0001009
   D   1.2348634D+03      0.0016294     -0.0007223
   D   4.8159603D+02      0.0085844     -0.0038390
   D   2.1319864D+02      0.0345050     -0.0155003
   D   1.0086916D+02      0.1065621     -0.0487935
   D   4.9953994D+01      0.2381576     -0.1096139
   D   2.5455172D+01      0.3562758     -0.1591411
   D   1.3408888D+01      0.3171829     -0.1036250
   D   7.2160589D+00      0.1403369      0.1342824
   D   3.8636778D+00      0.0255664      0.3783404
   D   2.0773504D+00      0.0007608      0.3922810
   D   1.1422155D+00      0.0002522      0.1957536
   D   6.5557124D-01     -0.0001499      0.0584945
   D   3.3802366D-01      0.0000117      0.0084974