%chk=000215703.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215703

0 1
S -5.266958 0.581384 -0.732532
O 0.472620 -2.959923 0.265796
O -6.096899 -0.592092 -0.542294
O -5.635857 1.858133 -0.148458
N 0.374991 -0.661281 0.654100
N -5.241349 0.850334 -2.434485
C 2.687936 -0.274696 1.319739
C 1.308648 0.412719 1.115451
C 2.451628 -1.775514 1.056847
C 1.015025 -1.936749 0.609524
C 3.742092 0.303850 0.405034
C -0.973373 -0.369302 0.324242
C 4.896517 0.880209 0.953243
C 3.579343 0.269024 -0.988811
C -1.848484 -1.399405 -0.088771
C -1.450922 0.959973 0.411695
C -3.639791 0.218958 -0.331924
C -3.166769 -1.098577 -0.409195
C -2.775148 1.237586 0.083605
C 5.878198 1.416790 0.114105
C 4.562376 0.806105 -1.822781
C 5.713586 1.381171 -1.273386
H 3.000786 -0.136866 2.383766
H 0.941055 0.854433 2.065682
H 1.362777 1.227575 0.361048
H 2.636665 -2.387880 1.961136
H 3.137499 -2.184477 0.285831
H 5.036975 0.912482 2.032289
H 2.684978 -0.177762 -1.422485
H -1.495721 -2.435654 -0.155502
H -0.807333 1.773938 0.731816
H -3.843460 -1.905861 -0.716001
H -3.144045 2.268246 0.162400
H 6.773670 1.863118 0.544967
H 4.432019 0.776328 -2.904104
H 6.478842 1.799064 -1.925375
H -5.431294 1.790976 -2.771591
H -5.723823 0.181745 -3.030418


%chk=000215703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215703

0 1
S -5.572159 0.706391 -0.381082
O 0.278586 -3.077188 0.374806
O -6.451201 -0.421911 0.398847
O -5.720824 2.307193 -0.111806
N 0.315289 -0.691233 0.313808
N -5.891347 0.475923 -2.184977
C 2.636003 -0.322127 0.845732
C 1.345740 0.380457 0.323264
C 2.415808 -1.803759 0.441553
C 0.896893 -1.980091 0.384889
C 3.926648 0.315084 0.347108
C -1.062736 -0.392038 0.141048
C 4.860760 0.853642 1.266387
C 4.224776 0.383506 -1.040002
C -2.064138 -1.401227 0.265844
C -1.453163 0.948775 -0.147348
C -3.762532 0.259569 -0.188352
C -3.422215 -1.071500 0.100152
C -2.810606 1.281185 -0.314283
C 6.064319 1.444255 0.817490
C 5.424732 0.972715 -1.492620
C 6.350342 1.506116 -0.564689
H 2.620239 -0.267212 1.950271
H 1.042221 1.208004 0.987282
H 1.490482 0.788325 -0.696199
H 2.858569 -2.525268 1.145805
H 2.833586 -2.024581 -0.559035
H 4.646014 0.808501 2.341512
H 3.521414 -0.029388 -1.774883
H -1.765890 -2.427754 0.483151
H -0.705631 1.738908 -0.252465
H -4.201467 -1.830816 0.219497
H -3.123453 2.310451 -0.515491
H 6.774980 1.853425 1.544091
H 5.640161 1.015523 -2.566133
H 7.282124 1.962637 -0.915991
H -6.249238 1.374146 -2.552104
H -6.566086 -0.300536 -2.290874


