%chk=000286913.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286913

0 1
S 0.255513 -0.312901 -1.195020
O -0.627849 -0.131414 0.239825
O 0.163944 0.837680 -2.037527
O -0.131647 -1.603915 -1.713406
O 2.483952 2.691152 1.031809
O 0.693158 1.913571 0.081117
N 1.844404 1.823110 0.467706
C -2.942839 -0.825706 0.227485
C -1.977403 0.196490 0.138759
C -2.554148 -2.272896 0.316875
C 1.854298 -0.494706 -0.490428
C 2.517829 0.509939 0.224031
C -4.289619 -0.432776 0.233501
C -2.312957 1.552581 0.047509
C 2.496128 -1.718380 -0.676542
C -2.051407 -2.623413 1.716901
C -4.645988 0.916210 0.145268
C -3.662541 1.907535 0.051543
C 3.802916 0.319409 0.735865
C 3.787955 -1.928502 -0.166349
C 4.439382 -0.913904 0.533650
H -3.406730 -2.926017 0.043901
H -1.761126 -2.494488 -0.438151
H -5.067663 -1.191668 0.307917
H -1.522993 2.305084 -0.024902
H 1.990880 -2.529405 -1.223646
H -1.191881 -1.996194 1.990294
H -1.737243 -3.670284 1.774370
H -2.826750 -2.461616 2.474266
H -5.698000 1.196974 0.148427
H -3.946609 2.956283 -0.019342
H 4.301513 1.125238 1.287569
H 4.278202 -2.892189 -0.321234
H 5.445119 -1.073082 0.929560


%chk=000286913-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286913

0 1
S 0.356874 -0.559776 -1.248831
O -0.794594 -0.394122 0.500824
O 0.115227 0.594904 -2.367993
O 0.241119 -2.110471 -1.749262
O 2.807628 3.005367 0.562609
O 0.829880 2.045836 -0.039666
N 2.091662 1.994063 0.204910
C -3.161890 -0.861629 0.237535
C -2.070200 0.077577 0.347215
C -2.899643 -2.354408 0.202667
C 2.132715 -0.466780 -0.463285
C 2.764394 0.673608 0.079078
C -4.472373 -0.335492 0.222989
C -2.307845 1.488687 0.367711
C 2.807944 -1.697521 -0.516131
C -2.626266 -2.930900 1.620678
C -4.708235 1.060571 0.271227
C -3.624636 1.974903 0.340116
C 4.092259 0.583393 0.557449
C 4.132416 -1.789041 -0.029464
C 4.773441 -0.648454 0.503254
H -3.774761 -2.866916 -0.238727
H -2.027964 -2.571191 -0.440517
H -5.321334 -1.026384 0.158791
H -1.443677 2.157970 0.405485
H 2.291337 -2.563643 -0.944354
H -1.726286 -2.463782 2.056648
H -2.458870 -4.021634 1.563965
H -3.478024 -2.746321 2.300341
H -5.736985 1.437199 0.241519
H -3.814363 3.052956 0.363210
H 4.555737 1.485774 0.965567
H 4.655972 -2.749288 -0.072347
H 5.799141 -0.717253 0.878390


