%chk=000209145.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209145

0 1
S 3.146687 1.730001 0.419554
S 0.611550 2.967486 1.411332
O 1.332595 -1.441638 -0.832615
O -4.607708 -0.548652 0.657926
N 0.841449 0.576678 0.199272
C 3.168951 0.101175 -0.403610
C 4.095071 -0.860358 0.331660
C 1.732130 -0.393097 -0.400134
C 5.574882 -0.501409 0.138261
C 1.390421 1.752675 0.696167
C -0.586978 0.315547 0.291268
C 6.482443 -1.526939 0.812259
C -1.050534 -0.640540 1.217726
C -1.471087 1.012329 -0.542183
C -2.409924 -0.900374 1.304683
C -2.842746 0.759368 -0.459223
C -3.299560 -0.193344 0.462648
C -5.638313 0.117165 -0.145220
C -6.920273 -0.521090 0.350085
H 3.502533 0.236620 -1.464879
H 3.910897 -1.894213 -0.041175
H 3.853177 -0.892459 1.414587
H 5.783478 0.505846 0.552789
H 5.816428 -0.443078 -0.941695
H 6.298970 -1.585261 1.891859
H 6.339121 -2.532810 0.400210
H 7.539351 -1.267376 0.676687
H -0.345660 -1.172990 1.857075
H -1.097548 1.753655 -1.250061
H -2.808398 -1.632638 2.004651
H -3.526126 1.303152 -1.102773
H -5.591169 1.200591 0.058582
H -5.437550 -0.092205 -1.209730
H -7.795910 -0.115365 -0.169098
H -6.908140 -1.610138 0.199768
H -7.056711 -0.357516 1.428746


%chk=000209145-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209145

0 1
S 3.209760 1.852802 0.198042
S 0.613066 3.115377 1.248070
O 1.359622 -1.511806 -0.835731
O -4.639382 -0.645846 0.677633
N 0.858837 0.595941 0.115010
C 3.195910 0.072493 -0.475660
C 4.122514 -0.872363 0.321017
C 1.735325 -0.384481 -0.437322
C 5.619080 -0.521409 0.174357
C 1.415558 1.824511 0.532121
C -0.558976 0.307987 0.243460
C 6.522410 -1.500533 0.953556
C -0.982488 -0.749096 1.082511
C -1.501979 1.067007 -0.477152
C -2.350667 -1.041557 1.200867
C -2.878393 0.783081 -0.360554
C -3.304953 -0.275194 0.483131
C -5.683555 0.115832 -0.040936
C -7.025618 -0.485148 0.366181
H 3.517574 0.118890 -1.531584
H 3.939602 -1.899609 -0.052826
H 3.832272 -0.855251 1.389431
H 5.795103 0.511893 0.535135
H 5.894324 -0.534504 -0.900022
H 6.287966 -1.483517 2.034228
H 6.387011 -2.538223 0.595405
H 7.589403 -1.239123 0.835941
H -0.245358 -1.340943 1.633303
H -1.165441 1.883705 -1.122479
H -2.704449 -1.854439 1.841275
H -3.596149 1.385852 -0.923141
H -5.617610 1.186171 0.242869
H -5.515318 0.026177 -1.133762
H -7.849275 0.046749 -0.143736
H -7.074309 -1.552367 0.090902
H -7.175616 -0.400266 1.455859


