%chk=000181812.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181812

0 1
N -0.022882 2.697558 -0.000306
C 1.115180 0.551219 -0.000016
C -0.119619 -0.126848 0.000106
C -1.305661 0.635356 -0.000047
C 1.127627 1.967021 -0.000201
C 2.387752 -0.199952 0.000031
C -2.643643 0.009203 -0.000030
C -0.151345 -1.618396 0.000459
C -1.207352 2.038541 -0.000248
C 2.408729 2.734475 -0.000274
C 2.993194 -0.555503 -1.215205
C 2.993024 -0.555658 1.215339
C -3.281643 -0.283959 -1.215074
C -3.281949 -0.283296 1.215027
C 4.197537 -1.264186 -1.210723
C 4.197342 -1.264322 1.210950
C -4.551434 -0.867425 -1.210988
C -4.551727 -0.866749 1.210943
C 4.800919 -1.619663 0.000124
C -5.187592 -1.159845 -0.000023
H 0.362187 -2.025471 0.885249
H -1.170239 -2.031741 -0.000229
H 0.363591 -2.026008 -0.883262
H -2.107222 2.666980 -0.000349
H 3.013134 2.496021 0.886685
H 3.012841 2.496285 -0.887512
H 2.237633 3.823661 -0.000098
H 2.523887 -0.277653 -2.157012
H 2.523552 -0.277880 2.157084
H -2.786572 -0.054600 -2.157123
H -2.787072 -0.053443 2.157055
H 4.667260 -1.539664 -2.153585
H 4.666957 -1.539946 2.153822
H -5.046624 -1.093396 -2.153938
H -5.047186 -1.092181 2.153886
H 5.738719 -2.171196 0.000191
H -6.176704 -1.613242 -0.000010


%chk=000181812-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181812

0 1
N -0.022968 2.708190 -0.000344
C 1.128245 0.548635 -0.000066
C -0.117729 -0.148018 0.000031
C -1.319140 0.621079 -0.000087
C 1.135606 1.977874 -0.000247
C 2.426342 -0.206204 0.000031
C -2.684618 -0.002091 -0.000023
C -0.144104 -1.664257 0.000317
C -1.205065 2.033687 -0.000274
C 2.426738 2.768393 -0.000335
C 3.054900 -0.565883 -1.221404
C 3.054532 -0.566211 1.221564
C -3.349206 -0.288722 -1.221844
C -3.349440 -0.287977 1.221847
C 4.282610 -1.266700 -1.222197
C 4.282239 -1.267019 1.222541
C -4.645335 -0.853134 -1.222353
C -4.645567 -0.852388 1.222451
C 4.900308 -1.619918 0.000216
C -5.297228 -1.138015 0.000073
H 0.379914 -2.070884 0.885252
H -1.174773 -2.052329 -0.000428
H 0.381413 -2.071279 -0.883535
H -2.109782 2.652991 -0.000371
H 3.046384 2.536754 0.885897
H 3.046097 2.537005 -0.886837
H 2.190499 3.843863 -0.000167
H 2.580572 -0.290631 -2.170877
H 2.579917 -0.291193 2.170962
H -2.847763 -0.065315 -2.170608
H -2.848170 -0.063997 2.170567
H 4.756004 -1.535601 -2.173468
H 4.755360 -1.536172 2.173876
H -5.145691 -1.067317 -2.173676
H -5.146110 -1.065992 2.173807
H 5.852144 -2.162919 0.000295
H -6.302536 -1.574207 0.000114


