%chk=000291514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291514

0 1
S 1.476929 -2.007979 0.402365
O 2.276390 -2.714701 1.385213
O 1.084095 -2.692638 -0.813006
N 0.061702 -1.558958 1.284784
C -1.082692 -1.036279 0.575892
C -1.276711 0.393393 0.602749
C -1.984452 -1.864128 -0.081118
C -2.387327 0.943972 -0.087518
C -3.100311 -1.281745 -0.760585
C -3.294134 0.073572 -0.770850
C -0.399798 1.278977 1.307280
C 2.209223 -0.498265 0.003870
C -2.588623 2.360892 -0.082510
C -1.812749 -3.344179 -0.126296
C -0.617343 2.634192 1.300921
C -1.724099 3.185021 0.592846
C 3.191846 0.037055 0.843832
C 1.827052 0.182038 -1.156656
C 3.789023 1.259866 0.526316
C 2.423754 1.406198 -1.474627
C 3.402283 1.944050 -0.632097
H -0.205048 -2.146151 2.087857
H -3.794086 -1.945099 -1.277433
H -4.143084 0.511304 -1.295132
H 0.441942 0.853302 1.856197
H -3.442079 2.767581 -0.622624
H -1.697492 -3.785325 0.871515
H -2.652251 -3.858732 -0.609501
H -0.903074 -3.608522 -0.708886
H 0.048174 3.307551 1.838231
H -1.870211 4.263581 0.602942
H 3.499811 -0.505140 1.745438
H 1.066257 -0.242264 -1.821128
H 4.555317 1.677395 1.177568
H 2.124609 1.938771 -2.376357
H 3.867259 2.899293 -0.879490


%chk=000291514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291514

0 1
S 1.421238 -1.786885 -0.162150
O 2.244783 -3.032505 0.508075
O 0.758927 -1.897986 -1.654891
N -0.060293 -1.365713 1.256068
C -1.289804 -1.004768 0.660025
C -1.563468 0.415378 0.511937
C -2.240490 -1.973207 0.225831
C -2.818610 0.834078 -0.071065
C -3.482465 -1.524806 -0.315944
C -3.764467 -0.164833 -0.470642
C -0.634715 1.414632 0.940793
C 2.549074 -0.274580 -0.162168
C -3.091155 2.233418 -0.223720
C -1.937239 -3.456305 0.308020
C -0.926622 2.773458 0.781760
C -2.160169 3.189037 0.189689
C 3.538600 -0.193764 0.831436
C 2.371708 0.679802 -1.176393
C 4.398291 0.929084 0.806601
C 3.242985 1.793501 -1.183810
C 4.247184 1.918245 -0.194518
H -0.074345 -2.339416 1.626788
H -4.215468 -2.272923 -0.638192
H -4.718113 0.152465 -0.909219
H 0.295844 1.088281 1.413515
H -4.045379 2.540996 -0.667729
H -1.756025 -3.796074 1.346865
H -2.777776 -4.049847 -0.087050
H -1.038401 -3.709138 -0.285655
H -0.208085 3.528640 1.119187
H -2.374537 4.256781 0.071590
H 3.645072 -0.988212 1.576806
H 1.594035 0.545170 -1.935029
H 5.183944 1.025715 1.563180
H 3.137342 2.556530 -1.961932
H 4.918702 2.783649 -0.208059


