%chk=000231409.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231409

0 1
S -1.281510 1.399680 -0.179733
O 2.464896 -0.957608 -0.989791
N -0.366823 -1.061283 0.106444
N 1.329780 0.684056 0.174716
C -2.583288 0.091569 -0.170513
C -1.811131 -1.251454 -0.101300
C -3.500044 0.325687 1.008096
C 0.033801 0.158990 0.049769
C 2.510238 0.040922 -0.316554
C 3.766259 0.768160 0.072184
H -3.140444 0.173010 -1.131400
H -2.186868 -1.897024 0.726615
H -1.951724 -1.837277 -1.039996
H -2.967288 0.276922 1.969130
H -3.985543 1.310689 0.964933
H -4.303116 -0.423574 1.046245
H 1.403869 1.581237 0.660914
H 4.644790 0.226584 -0.319820
H 3.895036 0.834858 1.161079
H 3.811312 1.785055 -0.340120


%chk=000231409-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231409

0 1
S -1.368152 1.409095 -0.705298
O 2.533690 -1.295064 -0.259534
N -0.451393 -1.068751 0.029429
N 1.237157 0.660689 -0.015124
C -2.666251 0.087997 -0.223734
C -1.874224 -1.261192 -0.329318
C -3.222464 0.356189 1.182567
C -0.058244 0.147533 -0.158849
C 2.459123 -0.063053 -0.046526
C 3.681190 0.813782 0.229058
H -3.457712 0.140142 -0.989739
H -2.321363 -2.012710 0.345814
H -1.921485 -1.657320 -1.363128
H -2.421837 0.284542 1.939938
H -3.675593 1.359779 1.252987
H -4.002019 -0.390236 1.431495
H 1.303203 1.673532 0.103728
H 4.521273 0.453363 -0.384869
H 3.972731 0.705283 1.289860
H 3.514571 1.885598 0.022141


