%chk=000210275.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210275

0 1
S 5.012072 -0.399409 -0.345896
S 6.548380 0.516002 0.238788
O 3.734514 0.389517 0.309006
O 4.873990 -1.842073 0.463767
O 4.698143 -0.750829 -1.694751
N 0.107819 0.789398 0.156920
C -2.850985 0.254241 -0.146356
C -2.283741 1.574203 0.442966
C -2.836858 -0.879673 0.900456
C -4.292166 0.466701 -0.660181
C -3.422588 -2.177386 0.326870
C -4.873797 -0.829016 -1.241779
C -4.844254 -1.964233 -0.209644
C -0.888317 1.398968 1.091059
C -2.235036 2.684659 -0.615041
C 1.512879 1.103696 0.547712
C 2.380603 -0.035499 -0.009434
H -2.210106 -0.058665 -1.005227
H -2.971164 1.907109 1.262626
H -3.406639 -0.575570 1.797135
H -1.796886 -1.066012 1.234127
H -4.309755 1.257871 -1.432425
H -4.935738 0.826160 0.164492
H -2.769398 -2.554021 -0.483841
H -3.426535 -2.961928 1.105996
H -5.911211 -0.654746 -1.582293
H -4.301295 -1.126503 -2.141203
H -5.222940 -2.898730 -0.662583
H -5.528988 -1.727958 0.626974
H -0.557472 2.381882 1.492828
H -0.965859 0.713507 1.966413
H -1.653119 2.390022 -1.494839
H -3.241334 2.940661 -0.969114
H -1.791806 3.602829 -0.215131
H -0.064209 1.120225 -0.799833
H 1.621619 1.137769 1.654644
H 1.885147 2.081475 0.172843
H 2.280113 -0.153270 -1.103745
H 2.189387 -0.992896 0.507371
H 4.613330 -2.625776 -0.055477


%chk=000210275-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210275

0 1
S 2.839593 -1.962461 -0.363281
S 4.833029 -2.675478 -0.154081
O 2.745283 -0.045048 -0.046232
O 1.783411 -2.417525 1.143895
O 1.898802 -2.381243 -1.620862
N 0.115143 2.533918 0.436775
C -2.233557 0.406527 -0.068848
C -2.318887 1.780157 0.671265
C -2.004901 -0.772203 0.920357
C -3.493556 0.102525 -0.925713
C -1.872115 -2.130810 0.190650
C -3.387150 -1.258905 -1.655981
C -3.119748 -2.422280 -0.674260
C -0.978663 2.196611 1.358155
C -2.818087 2.936551 -0.234977
C 1.420557 1.920648 0.503092
C 1.408198 0.480446 -0.170407
H -1.365717 0.451625 -0.764699
H -3.052814 1.667661 1.499600
H -2.869457 -0.817367 1.616991
H -1.107240 -0.604597 1.546403
H -3.653636 0.900042 -1.674931
H -4.386908 0.097978 -0.264332
H -0.974551 -2.111449 -0.463417
H -1.720763 -2.941228 0.931495
H -4.314086 -1.448782 -2.231487
H -2.558583 -1.210386 -2.392669
H -2.989833 -3.370513 -1.230531
H -4.000613 -2.554483 -0.011872
H -1.198732 3.073891 2.007146
H -0.620580 1.395583 2.030127
H -2.230925 3.010219 -1.172028
H -3.871988 2.796655 -0.527973
H -2.747945 3.906822 0.292690
H -0.122804 3.070424 -0.397428
H 1.748425 1.797541 1.549678
H 2.164873 2.542249 -0.022444
H 1.098350 0.571969 -1.230254
H 0.686081 -0.144028 0.387285
H 1.137890 -3.108551 0.807303


