%chk=000286918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286918

0 1
S 0.697167 -1.257087 0.384958
O 1.470769 0.232358 0.080136
O 0.962814 -1.589173 1.751715
O 1.051296 -2.143798 -0.686837
O -5.383704 0.735009 -1.397400
O -5.469846 1.187261 0.718702
N -4.906313 0.771352 -0.277620
C -0.925631 -0.675810 0.194021
C -1.519965 -0.694845 -1.071022
C -1.619187 -0.192251 1.307270
C -3.511286 0.262368 -0.111986
C -2.826421 -0.222414 -1.232758
C -2.926123 0.283158 1.159850
C 2.848788 0.324262 0.010853
C 3.634134 -0.648800 -0.617045
C 3.390618 1.498826 0.555053
C 5.012975 -0.430514 -0.689266
C 4.769414 1.692068 0.461614
C 5.580587 0.730738 -0.154339
H -0.971953 -1.083456 -1.939656
H -1.148369 -0.187893 2.299500
H -3.311405 -0.227789 -2.216287
H -3.488061 0.667159 2.019669
H 3.192374 -1.548576 -1.052535
H 2.739814 2.229158 1.028727
H 5.647737 -1.174950 -1.170971
H 5.216100 2.596449 0.874792
H 6.655278 0.888392 -0.216936


%chk=000286918-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286918

0 1
S 0.695061 -1.193335 0.658782
O 1.561209 0.397093 -0.252627
O 0.970882 -1.129374 2.260334
O 0.981114 -2.552592 -0.186141
O -5.580871 0.277443 -1.538533
O -5.602157 1.389373 0.453840
N -5.029405 0.652339 -0.435337
C -1.064425 -0.621607 0.318950
C -1.668408 -1.030470 -0.881817
C -1.690528 0.183944 1.284641
C -3.632192 0.203547 -0.169864
C -2.990357 -0.607964 -1.130641
C -3.012718 0.604135 1.034055
C 2.944766 0.446613 -0.189688
C 3.719001 -0.125412 -1.240263
C 3.578303 1.110764 0.900263
C 5.121017 0.004710 -1.214133
C 4.981325 1.232203 0.913527
C 5.753644 0.681246 -0.140259
H -1.129755 -1.670311 -1.587035
H -1.167960 0.455891 2.206545
H -3.522152 -0.890176 -2.042568
H -3.562100 1.228701 1.742650
H 3.204609 -0.647243 -2.053422
H 2.957971 1.521131 1.703238
H 5.723952 -0.422406 -2.022406
H 5.476746 1.748760 1.742380
H 6.845030 0.774199 -0.122270


