%chk=000277708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277708

0 1
S -4.747857 0.320209 -0.746141
O 3.371156 1.858225 0.109416
O 4.203076 -0.273398 -0.525878
O -4.003271 0.374949 1.778398
N -0.135426 -2.455001 0.102425
C -2.177342 -0.263131 -1.324722
C -2.238750 0.041174 0.142867
C 0.215231 -0.063260 0.557951
C -3.464219 0.156857 -2.030565
C -1.183731 0.128916 0.968081
C 2.358022 0.903022 0.188476
C 0.716835 -1.329929 0.181160
C 2.864670 -0.376490 -0.195396
C 1.052309 1.083463 0.569659
C -3.617029 0.260205 0.652920
C 2.083073 -1.503728 -0.203607
C 4.561673 1.141574 -0.342585
H -1.298441 0.240233 -1.784738
H -1.988374 -1.352071 -1.467708
H -3.352524 1.124848 -2.553087
H -3.791698 -0.586051 -2.779271
H -1.321894 0.381784 2.028669
H 0.665077 2.057148 0.864073
H 2.473009 -2.472109 -0.500297
H 4.848803 1.540767 -1.324242
H 5.314545 1.192235 0.454976
H 0.314921 -3.359264 0.146829
H -0.978043 -2.422674 0.663038


%chk=000277708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277708

0 1
S -4.957965 0.190762 -0.622286
O 3.592908 1.852300 0.421017
O 4.331279 -0.237876 -0.513180
O -3.845788 0.775918 1.845091
N -0.115967 -2.323240 -0.091498
C -2.405290 -0.656694 -1.268264
C -2.298124 -0.023065 0.104141
C 0.246500 0.056169 0.461983
C -3.650807 -0.061639 -1.969888
C -1.156431 0.318388 0.800061
C 2.510204 0.932918 0.327272
C 0.726366 -1.213308 -0.031912
C 2.952292 -0.292582 -0.224447
C 1.185622 1.121104 0.689134
C -3.613863 0.374326 0.683535
C 2.101556 -1.377699 -0.401887
C 4.774839 1.128431 -0.103755
H -1.493416 -0.483524 -1.865813
H -2.532666 -1.755812 -1.192798
H -3.436028 0.923377 -2.413848
H -4.069036 -0.734636 -2.732918
H -1.329693 0.930969 1.698908
H 0.839293 2.072840 1.101640
H 2.473302 -2.332498 -0.784243
H 5.160806 1.654769 -0.993612
H 5.527580 1.028068 0.697102
H 0.260378 -3.236103 -0.332657
H -1.034049 -2.283161 0.343824


