%chk=000272766.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272766

0 1
S -0.139947 1.783541 -0.808728
O 3.669277 -1.024588 0.531136
O 2.344283 -1.540383 -1.231201
N 0.350021 -0.353453 0.624930
C 1.667842 1.535690 -0.429677
C 1.694229 0.214094 0.411315
C 2.387613 1.447321 -1.757545
C 2.121866 2.720918 0.400102
C -0.617972 0.296766 0.083531
C 2.533777 -0.885788 -0.239533
C -2.042416 -0.037141 0.111153
C -2.446860 -1.357668 -0.149466
C -2.998761 0.953031 0.389510
C -3.805967 -1.680138 -0.138704
C -4.355014 0.618646 0.401137
C -4.759385 -0.694194 0.135408
C 4.613641 -2.053300 0.131264
H 2.126959 0.421198 1.436605
H 2.258078 2.356590 -2.360933
H 3.470022 1.309454 -1.628265
H 2.025784 0.609168 -2.378779
H 3.180800 2.632375 0.681672
H 2.021043 3.669354 -0.146621
H 1.545132 2.833292 1.329117
H -1.696980 -2.124380 -0.355635
H -2.688703 1.977264 0.600645
H -4.121250 -2.702617 -0.342732
H -5.099068 1.383952 0.617468
H -5.818474 -0.948877 0.143100
H 5.482803 -1.841813 0.762504
H 4.845715 -1.960685 -0.934470
H 4.179612 -3.034229 0.350094


%chk=000272766-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272766

0 1
S 0.046310 1.595957 -1.161815
O 3.726473 -1.111702 0.009442
O 1.868173 -1.654702 -1.289816
N 0.333777 -0.292779 0.769683
C 1.746658 1.538584 -0.243408
C 1.717543 0.118688 0.464202
C 2.890139 1.731383 -1.254607
C 1.745406 2.641831 0.836082
C -0.565188 0.291169 0.023362
C 2.388348 -0.977899 -0.381558
C -2.007854 -0.024384 0.080113
C -2.441585 -1.133034 0.859930
C -2.968319 0.744684 -0.628155
C -3.809841 -1.459067 0.928783
C -4.338101 0.412186 -0.559643
C -4.763467 -0.688682 0.219075
C 4.513961 -2.114935 -0.749701
H 2.291719 0.194318 1.404483
H 2.864868 2.750767 -1.677787
H 3.863930 1.595450 -0.748678
H 2.821547 1.011334 -2.087831
H 2.717415 2.652423 1.367752
H 1.588697 3.634388 0.380067
H 0.944612 2.473924 1.577259
H -1.687856 -1.719212 1.394285
H -2.645071 1.606274 -1.223833
H -4.136049 -2.314818 1.530089
H -5.071891 1.011221 -1.109669
H -5.827343 -0.945832 0.271883
H 5.519822 -2.075470 -0.309340
H 4.535757 -1.853500 -1.821185
H 4.065108 -3.115167 -0.631061


