%chk=000201464.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201464

0 1
S -4.349240 -1.688243 -0.052189
O -5.089387 2.056758 0.549991
O 5.646135 -0.263921 0.576654
O 4.652189 0.913767 -1.078337
N -3.461338 0.759238 -0.377045
C -1.704956 -0.953129 0.156380
C -0.453675 -0.310670 -0.458575
C -2.965264 -0.601061 -0.629686
C 0.809510 -0.706680 0.318225
C 2.059212 -0.072437 -0.302704
C -5.420294 -0.349689 0.524634
C 3.321957 -0.459044 0.473620
C -4.691217 0.945067 0.269309
C 4.544189 0.164641 -0.138272
C 6.940119 0.233241 0.145052
H -1.578163 -2.056576 0.187588
H -1.807245 -0.644719 1.218062
H -0.555080 0.792156 -0.466964
H -0.352262 -0.614421 -1.519473
H -2.825790 -0.762013 -1.729340
H 0.712865 -0.396663 1.377488
H 0.912499 -1.809528 0.334954
H 1.960834 1.032664 -0.329097
H 2.163208 -0.380317 -1.363597
H -2.843901 1.550117 -0.545595
H -5.653241 -0.466616 1.602721
H -6.392528 -0.367519 -0.010322
H 3.245118 -0.148035 1.538803
H 3.447196 -1.563582 0.507167
H 7.129239 -0.081845 -0.885896
H 7.627447 -0.242277 0.852386
H 6.959165 1.324637 0.225158


%chk=000201464-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201464

0 1
S -4.505589 -1.744409 0.151842
O -5.076529 2.219630 0.240901
O 5.756632 -0.376685 0.449504
O 4.607225 1.268201 -0.732823
N -3.453649 0.666830 -0.432178
C -1.731282 -1.057931 0.195105
C -0.483166 -0.360356 -0.398295
C -3.031530 -0.730213 -0.559020
C 0.818739 -0.774772 0.324760
C 2.069176 -0.073729 -0.248312
C -5.507653 -0.191704 0.525121
C 3.360908 -0.508179 0.471458
C -4.678355 1.030138 0.106161
C 4.590354 0.239132 -0.020077
C 7.029588 0.282499 0.066672
H -1.583081 -2.156013 0.160470
H -1.860538 -0.783948 1.259321
H -0.591351 0.742266 -0.328539
H -0.396129 -0.604526 -1.477743
H -2.942450 -1.012869 -1.625124
H 0.724824 -0.541684 1.405735
H 0.939969 -1.875661 0.251562
H 1.960156 1.024334 -0.167281
H 2.160025 -0.293501 -1.329977
H -2.829807 1.412667 -0.748828
H -5.730115 -0.129667 1.601763
H -6.451123 -0.202481 -0.042860
H 3.274612 -0.327123 1.562340
H 3.543262 -1.593477 0.361050
H 7.127405 0.316289 -1.031407
H 7.814662 -0.341050 0.516511
H 7.062109 1.311293 0.463287


