%chk=000210363.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210363

0 1
S -7.866079 -0.982853 1.166784
S -8.605992 -0.769976 -0.740216
O -7.321453 -1.480094 -1.555539
O -9.710806 -1.648182 -0.931806
O -8.610501 0.604391 -1.105136
N -4.193044 0.698767 0.693329
C 6.011951 -0.337833 -0.615434
C 6.098867 -1.804919 -0.143018
C 7.079610 0.525159 0.090541
C 7.505263 -2.371331 -0.379599
C 8.484706 -0.044328 -0.146183
C 8.576444 -1.509436 0.304094
C 4.625730 0.222434 -0.380287
C 4.088149 0.317731 0.912625
C 3.855923 0.657948 -1.469474
C 2.042344 1.275790 0.022168
C 2.808888 0.838381 1.113156
C 2.575595 1.179244 -1.271394
C 0.661357 1.832832 0.237384
C -0.388568 0.710910 0.200395
C -1.802039 1.261831 0.418528
C -2.843247 0.131495 0.383212
C -5.271948 -0.329922 0.560305
C -6.525417 0.249868 1.212492
H 6.232490 -0.320561 -1.713595
H 5.346494 -2.414264 -0.676644
H 5.842719 -1.874542 0.930798
H 6.872816 0.573495 1.176103
H 7.021779 1.565964 -0.277782
H 7.559531 -3.409390 -0.002191
H 7.709326 -2.429837 -1.465872
H 8.746801 0.034712 -1.218616
H 9.231880 0.564134 0.396500
H 9.582259 -1.910394 0.080940
H 8.458055 -1.569794 1.402927
H 4.673037 -0.016651 1.768235
H 4.255944 0.591393 -2.479894
H 2.405056 0.904356 2.121551
H 1.990737 1.511238 -2.126804
H 0.427974 2.597405 -0.530929
H 0.607914 2.370283 1.206083
H -0.328401 0.178661 -0.769203
H -0.149064 -0.045476 0.973924
H -2.035585 2.024717 -0.348621
H -1.862458 1.788825 1.393033
H -2.805699 -0.394563 -0.595277
H -2.606054 -0.625484 1.164385
H -4.391413 1.485194 0.063149
H -5.469557 -0.626851 -0.497492
H -4.954478 -1.257268 1.090541
H -6.845161 1.201956 0.739673
H -6.341485 0.486782 2.284298
H -7.537092 -2.131348 -2.243849


%chk=000210363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210363

0 1
S -7.875403 -1.174030 1.448292
S -9.139949 -0.446762 -0.566494
O -8.764065 -1.939165 -1.615883
O -10.749834 -0.351754 -0.433741
O -8.332995 0.822311 -1.184449
N -4.182327 0.420015 0.501669
C 6.194863 -0.240868 -0.558355
C 6.273564 -1.741238 -0.147988
C 7.271058 0.579647 0.211083
C 7.692881 -2.320222 -0.356526
C 8.690382 -0.000344 0.000438
C 8.756895 -1.492674 0.402903
C 4.786679 0.320842 -0.376368
C 4.184667 0.404116 0.907618
C 4.027441 0.764716 -1.488265
C 2.113103 1.338653 -0.047944
C 2.875260 0.903308 1.067418
C 2.715074 1.264420 -1.328609
C 0.678745 1.817286 0.124405
C -0.341839 0.645092 0.100518
C -1.796864 1.116703 0.313195
C -2.803648 -0.049587 0.272269
C -5.248785 -0.585550 0.570106
C -6.496561 0.062069 1.199883
H 6.447759 -0.181985 -1.639115
H 5.529215 -2.322262 -0.726139
H 5.992183 -1.839394 0.920905
H 7.030650 0.570690 1.294217
H 7.232856 1.637487 -0.113571
H 7.721151 -3.377515 -0.027987
H 7.934213 -2.315604 -1.440018
H 8.971287 0.100567 -1.068812
H 9.427962 0.587717 0.580683
H 9.769041 -1.897629 0.208382
H 8.578442 -1.583701 1.494739
H 4.744205 0.077298 1.792663
H 4.471679 0.718370 -2.490851
H 2.436235 0.960847 2.072088
H 2.152915 1.603127 -2.208466
H 0.416463 2.533629 -0.679026
H 0.570393 2.358886 1.085047
H -0.253613 0.110456 -0.866617
H -0.067274 -0.085733 0.887527
H -2.059750 1.859180 -0.470358
H -1.889610 1.635299 1.287494
H -2.703349 -0.589695 -0.701347
H -2.557215 -0.783158 1.065775
H -4.432116 1.253676 -0.045835
H -5.526055 -1.023591 -0.416907
H -4.895119 -1.419859 1.205534
H -6.894190 0.857129 0.533908
H -6.275837 0.516699 2.183272
H -9.486761 -1.997315 -2.310062


