%chk=000208396.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208396

0 1
S -1.272678 -0.564324 0.397768
O -0.187881 -2.949079 0.828385
N 2.155817 -0.075849 0.623037
N 1.763151 -2.966127 -0.353012
C -3.293247 1.173271 0.088825
C -1.939860 0.852095 -0.535144
C 0.226163 -1.017469 -0.546986
C -4.380181 0.154341 -0.283920
C 1.246993 0.063580 -0.385333
C -5.738041 0.550368 0.290936
C 0.573421 -2.363441 0.085702
C 1.254113 1.181815 -1.245294
C 2.189792 2.194727 -1.023158
C 3.055675 0.919308 0.825418
C 3.101278 2.075597 0.029625
H -3.210411 1.246140 1.194020
H -3.607557 2.185855 -0.241435
H -2.036832 0.605920 -1.606468
H -1.256079 1.716929 -0.451255
H -0.023944 -1.179102 -1.624811
H -4.451104 0.060279 -1.384705
H -4.099041 -0.854099 0.084835
H -6.506606 -0.185096 0.026029
H -6.072169 1.523752 -0.084049
H -5.710481 0.609989 1.385373
H 0.547040 1.256184 -2.067426
H 2.209007 3.072866 -1.669619
H 3.756377 0.767459 1.655955
H 3.831848 2.855279 0.228571
H 2.526922 -2.395131 -0.682591
H 2.064213 -3.796837 0.143924


%chk=000208396-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208396

0 1
S -1.234336 -0.699568 0.237741
O 0.410740 -3.335269 -1.514477
N 2.070821 -0.013051 0.620135
N 1.445358 -2.706694 0.487687
C -3.357224 1.134677 -0.125015
C -2.090509 0.620263 -0.832821
C 0.329672 -0.975981 -0.858539
C -4.463080 0.068481 0.057873
C 1.359946 0.091445 -0.551457
C -5.737340 0.653897 0.702874
C 0.745111 -2.454873 -0.667239
C 1.556170 1.180258 -1.439945
C 2.483846 2.191383 -1.104373
C 2.963840 0.963407 0.932304
C 3.200218 2.088775 0.108869
H -3.082549 1.561810 0.860302
H -3.762923 1.973702 -0.728312
H -2.337906 0.156139 -1.805010
H -1.367817 1.441564 -0.989050
H -0.020429 -0.890944 -1.899084
H -4.709796 -0.370348 -0.930000
H -4.076781 -0.763711 0.677419
H -6.518711 -0.118503 0.822393
H -6.159052 1.468698 0.083816
H -5.519674 1.070954 1.704417
H 0.995821 1.222310 -2.379580
H 2.646447 3.039216 -1.778211
H 3.507987 0.833746 1.874494
H 3.927302 2.848762 0.409908
H 1.782281 -1.896229 1.036246
H 1.728265 -3.665117 0.689830


