%chk=000191041.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191041

0 1
O 4.612891 2.326662 0.838760
N -1.647411 -0.362531 0.027166
C 1.132868 -1.083553 0.617352
C 0.318809 -1.805613 -0.496443
C -0.723749 -0.806010 -1.062415
C 0.157599 -0.612115 1.728543
C -0.945260 0.300601 1.171439
C 0.033815 0.320913 -1.806595
C 1.797641 0.166608 0.037917
C 2.178222 -2.045644 1.238978
C -0.361622 -3.104238 -0.023608
C -2.760600 0.495780 -0.494102
C 1.257793 0.823278 -1.093107
C -3.917763 0.456508 0.490091
C -4.221662 1.668163 1.390704
C -5.106032 1.316172 0.259166
C 2.921315 0.710147 0.668525
C 3.223426 -2.547148 0.247285
C -0.681568 -4.043996 -1.184090
C 1.869938 1.984238 -1.587706
C 3.507066 1.873772 0.151417
C 3.003101 2.527183 -0.978364
C -6.178765 1.585605 -0.445804
H 1.029152 -2.063532 -1.321139
H -1.365220 -1.345410 -1.809942
H 0.710311 -0.074772 2.520930
H -0.303122 -1.494986 2.211826
H -1.703282 0.489646 1.963988
H -0.515876 1.288432 0.893410
H -0.654550 1.165430 -2.008523
H 0.336184 -0.057296 -2.806245
H 1.644905 -2.915921 1.678439
H 2.683669 -1.544963 2.088720
H -1.293808 -2.858042 0.527309
H 0.290385 -3.628216 0.705396
H -2.448098 1.543604 -0.695926
H -3.113231 0.075741 -1.464036
H -4.068451 -0.546028 0.920305
H -3.596941 2.557306 1.334036
H -4.550708 1.501758 2.414583
H 3.358646 0.248921 1.553545
H 2.771631 -3.157189 -0.543701
H 3.750913 -1.717635 -0.240898
H 3.977227 -3.164187 0.748653
H -1.359276 -3.575706 -1.907027
H 0.222108 -4.346773 -1.723992
H -1.171206 -4.956473 -0.825195
H 1.455915 2.481034 -2.465360
H 3.468070 3.423827 -1.369790
H -6.486453 0.997565 -1.299244
H -6.837671 2.413562 -0.223189
H 4.986721 3.145819 0.435960


%chk=000191041-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191041

0 1
O 4.758710 2.386921 0.812543
N -1.627823 -0.350499 -0.006182
C 1.165864 -1.050639 0.630328
C 0.353360 -1.791071 -0.498888
C -0.688360 -0.794497 -1.075947
C 0.152171 -0.549814 1.717413
C -0.969974 0.328450 1.135377
C 0.061835 0.339088 -1.831277
C 1.859800 0.195401 0.021655
C 2.184793 -2.004903 1.325706
C -0.312239 -3.124519 -0.066589
C -2.818839 0.363960 -0.514404
C 1.303920 0.858253 -1.115053
C -3.985527 0.344179 0.475310
C -4.248571 1.557255 1.446973
C -5.148437 1.265996 0.290794
C 3.011085 0.752148 0.631920
C 3.233927 -2.652240 0.397109
C -0.856837 -3.948292 -1.256344
C 1.926071 2.032299 -1.604452
C 3.613583 1.923139 0.130381
C 3.076454 2.577872 -1.001417
C -6.225111 1.614680 -0.431877
H 1.060530 -2.024165 -1.323582
H -1.312885 -1.323386 -1.821613
H 0.699633 0.022810 2.491116
H -0.298099 -1.431288 2.213088
H -1.731445 0.510015 1.914318
H -0.559588 1.326993 0.842755
H -0.631105 1.179446 -2.037101
H 0.358529 -0.056084 -2.825671
H 1.615057 -2.798225 1.846443
H 2.702330 -1.453151 2.134465
H -1.139438 -2.908058 0.634823
H 0.420744 -3.753238 0.472766
H -2.607776 1.431731 -0.783599
H -3.137053 -0.142183 -1.447483
H -4.185447 -0.654295 0.887719
H -3.565321 2.413680 1.378335
H -4.593704 1.337895 2.464441
H 3.473501 0.291799 1.509302
H 2.761522 -3.313094 -0.352485
H 3.816258 -1.886659 -0.145916
H 3.944156 -3.267278 0.979964
H -1.683798 -3.431322 -1.776357
H -0.062115 -4.148806 -2.000904
H -1.247751 -4.923370 -0.911394
H 1.493075 2.535500 -2.478232
H 3.538697 3.490743 -1.399114
H -6.532743 1.041933 -1.315573
H -6.838280 2.482707 -0.160555
H 5.110658 3.206480 0.384969


