%nprocshared=12
%mem=24GB
#p b3lyp/genecp scrf=(smd,solvent=dichloromethane) nosymm pop=full
empiricaldispersion=gd3 gfinput gfprint scf=(maxcyc=400,xqc)

Title Card Required

0 1
 C                  0.60890000   -0.22107500    0.08773600
 C                  0.95050900   -0.98192400   -1.17304100
 C                  1.81679100   -0.11158400    0.99975500
 C                  0.09925800    1.14546800   -0.32167500
 C                 -0.52745300    1.50506800   -1.49909200
 H                 -0.74895300    0.96555900   -2.40603900
 C                  0.26910000   -2.01363000   -1.77723300
 H                 -0.60596300   -2.57574400   -1.49545600
 C                  1.95491900   -0.52150400    2.30735100
 H                  1.28221600   -0.99773700    3.00195300
 N                  3.22952600   -0.19414100    2.63424800
 N                 -0.82314700    2.81215800   -1.33625800
 N                  0.94847800   -2.22985100   -2.93257400
 N                  0.14377200    2.23934800    0.49008600
 N                 -0.41285100    3.25023400   -0.12477100
 N                  1.97940700   -1.38092300   -3.05317400
 N                  1.98155600   -0.62508000   -1.98653100
 N                  3.00826500    0.41713200    0.60894700
 N                  3.86605700    0.36576900    1.59694400
 Cu                 3.76841500    0.69373200   -1.41268700
 O                 -0.39182800   -1.01772600    0.73798400
 C                 -1.28233600   -0.34017900    1.62600700
 H                 -2.01208700    0.27038000    1.07994700
 H                 -1.80979600   -1.12939600    2.16862100
 H                 -0.75443000    0.29999700    2.34188400
 C                  0.57602300   -3.07222900   -4.06700000
 H                  1.50167700   -3.26157500   -4.61828400
 H                  0.21068500   -4.02437200   -3.67548300
 C                 -1.53092700    3.71460900   -2.24939800
 H                 -2.60184300    3.49717500   -2.19054100
 H                 -1.36710400    4.71822300   -1.84660900
 C                  3.93445200   -0.43008100    3.89009000
 H                  4.68676000    0.35861800    3.97480400
 H                  3.21145300   -0.28376600    4.69796500
 C                 -0.46516000   -2.40817900   -4.95245200
 C                 -0.42269200   -1.03071200   -5.21296500
 C                 -1.46662700   -3.18540100   -5.54509700
 C                 -1.37036500   -0.44318100   -6.05335000
 H                  0.35072400   -0.41507400   -4.76398200
 C                 -2.41039700   -2.59833100   -6.39269300
 H                 -1.50975000   -4.25298100   -5.34199500
 C                 -2.36559700   -1.22537600   -6.64711800
 H                 -1.32783500    0.62585500   -6.24179500
 H                 -3.18383200   -3.21308300   -6.84561000
 H                 -3.10286500   -0.76705800   -7.30105400
 C                  4.58391700   -1.80120700    3.98735900
 C                  5.34934500   -2.08399200    5.12755200
 C                  4.46033100   -2.76919700    2.98697100
 C                  5.98492500   -3.31841900    5.26430600
 H                  5.45251700   -1.33141400    5.90660400
 C                  5.09494800   -4.00747300    3.12773300
 H                  3.90673700   -2.55801300    2.07828800
 C                  5.85825600   -4.28665400    4.26170900
 H                  6.57911600   -3.52440800    6.15088800
 H                  5.00554700   -4.74309200    2.33335400
 H                  6.35783300   -5.24640300    4.36338700
 C                 -1.04180500    3.60633000   -3.67831700
 C                 -1.96207200    3.46834900   -4.72322100
 C                  0.32777600    3.67580200   -3.97123100
 C                 -1.52395600    3.41582600   -6.05022800
 H                 -3.02451900    3.40553200   -4.50018700
 C                  0.76452600    3.61750500   -5.29495700
 H                  1.05249600    3.75412300   -3.16497100
 C                 -0.15897400    3.49041400   -6.33895100
 H                 -2.24836700    3.31252000   -6.85385500
 H                  1.82768100    3.67492700   -5.51182100
 H                  0.18407600    3.44888300   -7.36940300
 N                  5.35306900   -0.51193700   -1.29387300
 S                  5.16819500   -2.12637700   -1.03552900
 O                  3.91720300   -2.34392200   -0.28075600
 O                  5.37471900   -2.95133300   -2.25245200
 C                  6.54320700   -2.49331300    0.06593400
 C                  6.87320400   -1.59775200    1.08963600
 C                  7.21161000   -3.71059300   -0.06225900
 C                  7.88063200   -1.93610000    1.98760800
 H                  6.33932800   -0.65818000    1.17957900
 C                  8.21391800   -4.03781800    0.85378700
 H                  6.95248800   -4.38989000   -0.86772100
 C                  8.55938400   -3.16237000    1.89172700
 H                  8.13253400   -1.24787800    2.79076900
 H                  8.73303700   -4.98836700    0.75893300
 C                  9.62110800   -3.52054200    2.90169700
 H                  9.18981000   -3.58419000    3.90889700
 H                 10.08972500   -4.48305600    2.67293500
 H                 10.40845200   -2.75741900    2.93682000
 Cl                 3.21310100    2.94720300   -1.70030000
 C                  5.18574900    0.68562200   -3.16872800
 C                  6.22640200   -0.10044900   -2.41149300
 H                  6.59978200   -0.94902400   -2.99146800
 H                  5.21102600    1.76454200   -3.03424300
 C                  4.41779400    0.19689200   -4.28461300
 C                  4.58865000   -1.09986000   -4.82553300
 C                  3.47652700    1.06856700   -4.88947100
 C                  3.87653000   -1.48669500   -5.95475700
 H                  5.25602200   -1.80359800   -4.34356000
 C                  2.75597700    0.66692800   -6.00508200
 H                  3.31007700    2.04406900   -4.44293700
 C                  2.95812800   -0.61049300   -6.54494800
 H                  4.02147700   -2.48065500   -6.36857800
 H                  2.02547800    1.33657900   -6.44785500
 H                  2.38854700   -0.92527700   -7.41499200
 C                  7.38893900    0.75038400   -1.91874300
 H                  7.01602900    1.58974600   -1.32031200
 H                  8.05659300    0.14861400   -1.29339700
 H                  7.96211500    1.14857900   -2.76552600

-Cu 0
S   1   1.00
      8.1760000              1.0000000
S   1   1.00
      2.5680000              1.0000000
S   1   1.00
      0.9587000              1.0000000
S   1   1.00
      0.1153000              1.0000000
S   1   1.00
      0.0396000              1.0000000
P   1   1.00
     25.6300000              1.0000000
P   1   1.00
      3.1660000              1.0000000
P   1   1.00
      1.0230000              1.0000000
P   1   1.00
      0.0860000              1.0000000
P   1   1.00
      0.0240000              1.0000000
D   3   1.00
     41.3400000              0.0465424
     11.4200000              0.2227824
      3.8390000              0.4539059
D   1   1.00
      1.2300000              1.0000000
D   1   1.00
      0.3102000              1.0000000
****
-I     0
S   2   1.00
      0.7242000             -2.9731048
      0.4653000              3.4827643
S   1   1.00
      0.1336000              1.0000000
P   2   1.00
      1.2900000             -0.2092377
      0.3180000              1.1035347
P   1   1.00
      0.1053000              1.0000000
P   1   1.00
      0.0308000              1.0000000
D   1   1.00
      0.2940000              1.0000000
****
-N -C -H -O -Cl -S -B 0
6-311++g**
****

-Cu 0
U-ECP     2     10
d-ul potential
  3
1    511.9951763            -10.0000000
2     93.2801074            -72.5548282
2     23.2206669            -12.7450231
s-ul potential
  4
0    173.1180854              3.0000000
1    185.2419886             23.8351825
2     73.1517847            473.8930488
2     14.6884157            157.6345823
p-ul potential
  4
0    100.7191369              5.0000000
1    130.8345665              6.4990936
2     53.8683720            351.4605395
2     14.0989469             85.5016036
-I     0
I-ECP     3     46
f-ul potential
  5
0      1.0715702             -0.0747621
1     44.1936028            -30.0811224
2     12.9367609            -75.3722721
2      3.1956412            -22.0563758
2      0.8589806             -1.6979585
s-ul potential
  5
0    127.9202670              2.9380036
1     78.6211465             41.2471267
2     36.5146237            287.8680095
2      9.9065681            114.3758506
2      1.9420086             37.6547714
p-ul potential
  5
0     13.0035304              2.2222630
1     76.0331404             39.4090831
2     24.1961684            177.4075002
2      6.4053433             77.9889462
2      1.5851786             25.7547641
d-ul potential
  5
0     40.4278108              7.0524360
1     28.9084375             33.3041635
2     15.6268936            186.9453875
2      4.1442856             71.9688361
2      0.9377235              9.3630657





