%nprocshared=8
%mem=20GB
#p wB97XD/gen scrf=(smd,solvent=dmso) nosymm scf=xqc Int=Grid=UltraFine

HE

1 2
 C                  0.69020000    1.27192500    1.51158700
 C                  1.15553100    2.24659500    0.65748600
 C                 -1.17652100    2.50078500   -0.24386300
 C                 -1.58959100    1.51277200    0.62308100
 C                  2.56977800    2.71830700    0.59932400
 C                 -2.06983100    3.23044200   -1.18985600
 C                  1.46706000    0.50052900    2.53223900
 H                  2.15838500   -0.18839700    2.04161000
 H                  2.05483500    1.17365700    3.15763900
 H                  0.79373200   -0.07451800    3.17086400
 C                 -2.97090000    0.96120200    0.79096400
 H                 -3.68743100    1.76646300    0.95943400
 H                 -3.27714500    0.42661500   -0.11092600
 H                 -3.01069800    0.27318000    1.63753700
 O                 -3.26770200    2.68474000   -1.33275700
 O                  3.43334800    1.90264300    1.18428200
 O                  2.87248400    3.75501800    0.03876200
 O                 -1.69650700    4.23114800   -1.77299300
 C                  4.82790100    2.29658400    1.17500000
 H                  5.16136900    2.34943900    0.13527700
 H                  4.90918100    3.29049200    1.62242500
 C                 -4.19939500    3.35129100   -2.21995300
 H                 -4.31271300    4.38568100   -1.88536500
 H                 -3.77545000    3.35138400   -3.22763500
 C                  5.59298700    1.25949200    1.96154500
 H                  6.65358300    1.52810400    1.96474400
 H                  5.24656700    1.21611800    2.99830000
 H                  5.49225500    0.26760800    1.51132100
 C                 -5.50226000    2.59128400   -2.15334000
 H                 -5.90764900    2.59355600   -1.13733100
 H                 -6.22876300    3.07337300   -2.81421400
 H                 -5.37423500    1.55598400   -2.48263400
 C                  0.23715600    2.94117600   -0.27344400
 H                  0.28858000    4.02894400   -0.09507800
 H                  0.62561600    2.85719700   -1.30356700
 N                 -0.63984700    0.96882900    1.44047600
 H                 -0.96531700    0.24926200    2.08364600

-C -P -O -H -N 0
6-311++g(d,p)
****

