%chk=000210378.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210378

0 1
S 5.173201 -0.608299 0.408620
S 5.515801 0.897679 -0.951386
O -2.424871 -0.576178 0.788409
O 4.347237 1.962734 -0.388890
O 6.767222 1.520267 -0.681187
O 5.096760 0.478992 -2.244116
N 1.159765 -1.064711 -0.071911
C -1.273144 -1.305698 0.250783
C -0.025449 -0.470789 0.612859
C -1.339190 -2.644560 0.991008
C 2.438490 -0.429707 0.379338
C -2.357326 -3.592251 0.367773
C -2.980009 0.451876 0.057168
C 3.581184 -1.290469 -0.154955
C -4.067013 1.091227 0.714035
C -2.550246 0.852304 -1.210585
C -4.699131 2.143794 0.052832
C -4.509656 0.649228 2.068269
C -3.210118 1.913586 -1.844771
C -4.275237 2.557482 -1.219909
H -1.390628 -1.428499 -0.846068
H 0.130952 -0.496642 1.714423
H -0.204492 0.597395 0.358909
H -0.327822 -3.104404 0.988609
H -1.595671 -2.461314 2.055314
H 1.061670 -0.947429 -1.088355
H 2.457348 -0.409907 1.493674
H 2.542721 0.631169 0.046477
H -2.447643 -4.515236 0.951795
H -2.081776 -3.876232 -0.653918
H -3.353151 -3.130079 0.326942
H 3.516334 -2.328537 0.240632
H 3.558996 -1.383593 -1.261206
H -1.727575 0.352316 -1.710822
H -5.535313 2.653503 0.530772
H -4.242741 1.390771 2.833808
H -5.596011 0.498356 2.112047
H -4.036239 -0.302138 2.361013
H -2.882182 2.231127 -2.833514
H -4.784269 3.381066 -1.714064
H 4.603222 2.894900 -0.287249


%chk=000210378-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210378

0 1
S 5.236425 -0.786152 0.698421
S 5.710737 0.780639 -1.168997
O -2.539626 -0.615011 0.785788
O 5.337743 2.344409 -0.224393
O 7.244887 0.865150 -1.672680
O 4.535135 0.575116 -2.273164
N 1.147192 -0.840031 0.050092
C -1.291509 -1.254139 0.307641
C -0.086445 -0.355757 0.692231
C -1.240170 -2.638130 0.969211
C 2.432370 -0.389209 0.612020
C -2.312073 -3.609275 0.435363
C -3.111999 0.446920 0.058553
C 3.556088 -1.258474 0.024240
C -4.292469 0.996589 0.644809
C -2.602078 0.948555 -1.164563
C -4.934157 2.055647 -0.034455
C -4.820202 0.444075 1.952562
C -3.269979 2.008441 -1.819216
C -4.437526 2.567093 -1.258093
H -1.341012 -1.372911 -0.796975
H 0.051267 -0.401798 1.788618
H -0.321566 0.703619 0.439313
H -0.224700 -3.044148 0.800342
H -1.363516 -2.500168 2.061182
H 1.121929 -0.784729 -0.976988
H 2.393529 -0.516418 1.710093
H 2.659591 0.683755 0.414834
H -2.255741 -4.583387 0.953633
H -2.180079 -3.796206 -0.647280
H -3.324475 -3.196622 0.589438
H 3.411122 -2.332638 0.245170
H 3.605403 -1.140040 -1.077954
H -1.698740 0.529523 -1.617525
H -5.841525 2.485985 0.405893
H -4.068164 0.535940 2.757764
H -5.735428 0.975448 2.264114
H -5.050343 -0.633906 1.866655
H -2.871383 2.392706 -2.764622
H -4.956045 3.389384 -1.761954
H 5.761532 3.103254 -0.726519


