%chk=000290025.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290025

0 1
S 0.321632 1.664307 -0.854137
O 0.584059 3.064036 -0.487125
O -0.004286 1.438522 -2.255697
C 1.726211 0.745223 -0.407950
C 1.643114 -0.637828 -0.032419
C -1.934678 0.154677 -0.067061
C 0.603951 -1.546890 -0.437287
C -0.369270 -1.249975 -1.545253
C -0.997573 1.200660 0.196113
C -1.728883 -0.931918 -0.994687
C 2.689333 -1.176311 0.771298
C 2.941074 1.407736 -0.318740
C -3.167255 0.170249 0.650934
C 0.521133 -2.802621 0.138406
C -1.208042 2.066411 1.250278
C -2.771208 -1.776022 -1.315682
C 3.889999 -0.418180 0.970959
C 4.038547 0.805794 0.386076
C 2.577156 -2.476349 1.347373
C -3.357945 1.089796 1.729465
C -4.223119 -0.731877 0.303680
C 1.487789 -3.262681 1.066994
C -2.377114 1.991782 2.053393
C 3.186277 2.750771 -0.906753
C -4.041659 -1.657777 -0.688656
H -0.421938 -2.137532 -2.219984
H -0.014227 -0.471410 -2.270070
H -0.293448 -3.475202 -0.137021
H -0.491194 2.872664 1.470376
H -2.632718 -2.572269 -2.047348
H 4.688754 -0.853832 1.574184
H 4.972402 1.359946 0.471029
H 3.369072 -2.830316 2.006034
H -4.294348 1.055706 2.288238
H -5.168672 -0.660339 0.838931
H 1.366877 -4.245327 1.518581
H -2.490766 2.678933 2.890155
H 2.876776 2.809962 -1.963613
H 2.585077 3.540198 -0.397433
H 4.234092 3.068180 -0.860894
H -4.843681 -2.328796 -0.991385


%chk=000290025-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290025

0 1
S 0.351140 1.803877 -0.869902
O 0.688164 3.296682 -0.284147
O -0.017106 1.726821 -2.463498
C 1.888084 0.704753 -0.404844
C 1.722347 -0.683190 -0.044955
C -2.066015 0.153746 -0.046908
C 0.634818 -1.548228 -0.440623
C -0.403332 -1.184546 -1.510324
C -1.194539 1.261356 0.226106
C -1.787928 -0.957839 -0.923729
C 2.807981 -1.270349 0.734044
C 3.101003 1.405303 -0.302759
C -3.340227 0.175187 0.667119
C 0.571257 -2.847811 0.089489
C -1.464998 2.246910 1.168563
C -2.789818 -1.910058 -1.157796
C 4.012689 -0.524637 0.937209
C 4.177557 0.734293 0.376111
C 2.692566 -2.600961 1.245534
C -3.611189 1.195061 1.636570
C -4.320989 -0.835286 0.401496
C 1.566430 -3.371339 0.960715
C -2.682425 2.195920 1.910615
C 3.384052 2.797000 -0.840569
C -4.063860 -1.846883 -0.519998
H -0.468481 -2.043194 -2.202851
H -0.082030 -0.330090 -2.130394
H -0.263637 -3.491404 -0.212573
H -0.764742 3.081348 1.285975
H -2.575579 -2.741824 -1.839360
H 4.822773 -0.984049 1.515085
H 5.130468 1.266278 0.473106
H 3.516758 -3.007185 1.843027
H -4.573622 1.173150 2.160847
H -5.274997 -0.795042 0.939572
H 1.469055 -4.388169 1.354673
H -2.888282 2.967265 2.659033
H 2.829908 3.014404 -1.767237
H 3.092036 3.575784 -0.116225
H 4.465440 2.888088 -1.045864
H -4.819427 -2.609041 -0.737031


