%chk=000210570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210570

1 1
S 2.647369 -1.795828 0.231690
N 2.790924 0.774334 0.157837
N -3.749840 -0.032525 0.046586
C 4.236142 0.371121 0.107754
C 1.884181 -0.209671 0.174613
C 4.343075 -1.132879 0.329387
C 0.465220 -0.133310 0.147697
C 2.491604 2.218691 0.174571
C -0.231290 0.823301 -0.645848
C -0.314164 -1.071019 0.890031
C -2.388336 -0.069044 0.074608
C -1.601761 0.862864 -0.690598
C -1.685466 -1.040457 0.869608
C -4.487635 0.958713 -0.768546
C -4.571600 -0.993439 0.816760
H 4.801202 0.936970 0.888302
H 4.660271 0.672482 -0.882123
H 4.976806 -1.627509 -0.437109
H 4.789022 -1.387477 1.313934
H 3.246761 2.772529 0.766371
H 1.507327 2.422394 0.643974
H 2.487706 2.641187 -0.848891
H 0.341300 1.522040 -1.261132
H 0.191646 -1.818132 1.511544
H -2.096272 1.598683 -1.322734
H -2.244006 -1.763165 1.463308
H -4.257371 0.843000 -1.844581
H -4.242634 1.992107 -0.459158
H -5.580284 0.836368 -0.655168
H -4.376406 -2.034209 0.495546
H -5.650691 -0.804818 0.670890
H -4.370501 -0.911098 1.901675


%chk=000210570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210570

1 1
S 2.700245 -1.867142 0.323052
N 2.819916 0.765238 0.072797
N -3.789930 -0.029396 0.049258
C 4.239253 0.330992 -0.123323
C 1.909286 -0.239080 0.177568
C 4.393580 -1.032254 0.569913
C 0.474559 -0.138533 0.161571
C 2.528704 2.212539 0.153155
C -0.230135 0.885918 -0.561225
C -0.320913 -1.137339 0.821684
C -2.415872 -0.067928 0.080789
C -1.620762 0.918977 -0.608975
C -1.710822 -1.103533 0.795981
C -4.496147 1.043131 -0.685055
C -4.587279 -1.068975 0.736981
H 4.915216 1.083854 0.314295
H 4.446831 0.256744 -1.208091
H 5.154921 -1.664560 0.093582
H 4.577781 -0.949725 1.651009
H 3.324595 2.702427 0.738460
H 1.567328 2.375236 0.662370
H 2.495746 2.675767 -0.849755
H 0.321138 1.625978 -1.148694
H 0.177163 -1.930852 1.390288
H -2.106141 1.697257 -1.202112
H -2.264482 -1.875319 1.334784
H -4.273936 1.004591 -1.768134
H -4.219194 2.041642 -0.299578
H -5.580541 0.918943 -0.556151
H -4.373521 -2.074865 0.330375
H -5.656719 -0.863181 0.589274
H -4.387569 -1.074351 1.824705


