%chk=000298357.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298357

0 1
S -2.113970 -0.320052 0.881519
O -1.819856 -1.747880 0.578491
N 0.614725 -0.037994 0.174711
N -0.503917 1.899593 0.517135
N 3.293061 -0.583322 -0.432084
C -0.613095 0.543389 0.470365
C 1.552957 1.029457 0.030604
C -3.142241 0.342517 -0.468253
C 0.811959 2.212644 0.251118
C 1.020812 -1.370592 0.012543
C 2.908787 0.673112 -0.279679
C -4.538578 -0.216900 -0.303854
C 2.341030 -1.600032 -0.283972
H -3.131893 1.449901 -0.406748
H -2.729123 0.090670 -1.462690
H 1.166895 3.229137 0.228986
H 0.248484 -2.151980 0.133286
H 3.655970 1.469556 -0.395839
H -4.551450 -1.316365 -0.364064
H -5.000231 0.069023 0.650202
H -5.203535 0.148839 -1.099810
H 2.733808 -2.613922 -0.425366


%chk=000298357-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298357

0 1
S -2.152601 -0.150738 1.137019
O -1.903106 -1.795695 0.883765
N 0.598221 0.030841 0.233286
N -0.379839 2.022956 0.725221
N 3.205162 -0.649975 -0.617927
C -0.556854 0.686520 0.640327
C 1.588232 1.058043 0.034857
C -3.169969 0.401894 -0.454204
C 0.931716 2.271088 0.348135
C 0.914937 -1.316843 0.009847
C 2.884371 0.635634 -0.398154
C -4.495156 -0.353901 -0.449312
C 2.204048 -1.605572 -0.403785
H -3.255790 1.496780 -0.362135
H -2.516444 0.127484 -1.297861
H 1.335479 3.279794 0.323501
H 0.112106 -2.036552 0.187606
H 3.666308 1.384637 -0.563959
H -4.317149 -1.443161 -0.403010
H -5.136971 -0.063000 0.401305
H -5.049186 -0.138360 -1.381514
H 2.493083 -2.643074 -0.586410


