%chk=000207864.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207864

0 1
S -2.944480 0.106328 0.222529
S 3.743103 -1.624510 -1.289321
P 3.959117 -0.166052 -0.104067
O 2.854928 -0.063301 1.136998
O -3.626264 0.008233 1.497715
O -3.245320 1.208959 -0.676181
O 3.867060 1.360431 -0.705353
O 5.339312 -0.062977 0.774468
N -3.243164 -1.360858 -0.631356
C -4.525585 -2.055472 -0.343138
C -1.233398 0.053663 0.456033
C -5.686316 -1.649464 -1.268029
C -0.675197 -0.883904 1.334183
C -0.415330 0.963017 -0.225543
C 1.503351 -0.017204 0.822208
C 0.705027 -0.932717 1.525169
C 0.968450 0.941119 -0.049956
C -6.178888 -0.228115 -1.025134
C 4.739252 1.634867 -1.833031
C 5.758100 -1.285146 1.436607
H -4.333024 -3.149211 -0.447772
H -4.807516 -1.890710 0.725438
H -3.053187 -1.345022 -1.642510
H -5.389371 -1.767127 -2.328704
H -6.522854 -2.361730 -1.114669
H -1.319404 -1.585306 1.876056
H -0.864387 1.705887 -0.899432
H 1.165684 -1.652456 2.199162
H 1.605231 1.666327 -0.563334
H -6.418280 -0.052237 0.031547
H -7.083121 -0.014487 -1.605211
H -5.429692 0.526856 -1.311746
H 4.481308 2.679770 -2.067614
H 4.506593 0.989292 -2.690773
H 5.793716 1.569238 -1.536754
H 6.708803 -0.974842 1.898171
H 5.935394 -2.097615 0.719150
H 5.039948 -1.569925 2.215795


%chk=000207864-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207864

0 1
S -3.093531 0.187713 0.066185
S 3.980279 -1.534933 -1.625491
P 4.131532 -0.126084 -0.134137
O 2.869153 -0.049048 1.071059
O -3.826436 0.072574 1.518443
O -3.363363 1.439027 -0.952196
O 4.185059 1.535743 -0.577259
O 5.489098 -0.204968 0.917155
N -3.423915 -1.452010 -0.813277
C -4.663576 -2.143925 -0.355015
C -1.237293 0.100626 0.343583
C -5.959921 -1.799700 -1.124007
C -0.758696 -0.645151 1.434041
C -0.406000 0.812925 -0.534915
C 1.490583 0.003495 0.758326
C 0.634370 -0.697354 1.638585
C 0.987629 0.768532 -0.319283
C -6.455693 -0.351591 -0.916449
C 5.197253 1.956335 -1.580258
C 5.947139 -1.529489 1.401979
H -4.440996 -3.226204 -0.436374
H -4.781916 -1.913661 0.722245
H -3.451673 -1.193068 -1.819872
H -5.808290 -1.999578 -2.205456
H -6.742268 -2.509233 -0.786744
H -1.451592 -1.157812 2.107820
H -0.840533 1.410169 -1.342678
H 1.067197 -1.265231 2.466450
H 1.670825 1.335466 -0.958889
H -6.625615 -0.143649 0.155502
H -7.406254 -0.184931 -1.454899
H -5.727497 0.395100 -1.284206
H 4.918352 2.988282 -1.837108
H 5.152875 1.310042 -2.476155
H 6.204105 1.928545 -1.130921
H 6.948311 -1.341149 1.815749
H 6.002699 -2.255155 0.569901
H 5.268199 -1.897050 2.190168


