%chk=000190736.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190736

0 1
S -0.998232 1.870520 -0.615410
O -4.044861 -0.442547 -0.399445
O 3.585837 -0.978321 0.319076
N 1.903567 0.566995 -0.156962
N -2.699872 1.497235 -0.669351
N 4.179406 1.231582 -0.001628
C -0.501974 0.224916 -0.257700
C -1.642819 -0.604395 -0.186928
C 0.781808 -0.306344 -0.056170
C -1.531202 -1.967244 0.081479
C 0.890739 -1.684319 0.214953
C -2.855288 0.208297 -0.434363
C -0.249933 -2.491914 0.279759
C 3.255186 0.165440 0.057425
C -5.233296 0.371809 -0.644440
C 5.619433 0.885334 -0.007039
H -2.419556 -2.594348 0.133292
H 1.880530 -2.132005 0.379693
H -0.131041 -3.555921 0.491743
H 1.695307 1.561431 -0.260549
H 3.945552 2.096326 -0.479827
H -5.313755 1.149986 0.121561
H -6.030667 -0.374484 -0.561778
H -5.180922 0.812368 -1.645402
H 5.786895 -0.081225 0.511329
H 6.176307 1.663428 0.542134
H 6.028652 0.794200 -1.026051


%chk=000190736-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190736

0 1
S -0.915616 1.879980 -0.657903
O -4.073454 -0.427327 -0.384295
O 3.703207 -1.060208 0.301351
N 1.942904 0.454825 -0.150594
N -2.699739 1.479658 -0.697634
N 4.168092 1.184627 -0.160449
C -0.472456 0.153483 -0.254253
C -1.647411 -0.636830 -0.166087
C 0.817909 -0.400731 -0.045075
C -1.567133 -2.017664 0.136799
C 0.890017 -1.785716 0.257293
C -2.834025 0.174322 -0.425441
C -0.290014 -2.569776 0.344048
C 3.300865 0.107242 0.017484
C -5.232133 0.451554 -0.662797
C 5.618581 1.018853 -0.024437
H -2.479618 -2.616472 0.202467
H 1.873563 -2.229733 0.421268
H -0.191002 -3.634535 0.580211
H 1.735852 1.431389 -0.371933
H 3.806520 2.109933 -0.393816
H -5.278423 1.268291 0.077898
H -6.106529 -0.209462 -0.583824
H -5.147077 0.885344 -1.673979
H 5.806924 -0.037557 0.224319
H 6.023146 1.652702 0.786450
H 6.142853 1.260606 -0.967672


