%chk=000181416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181416

0 1
O 0.065992 -0.748478 -2.171014
O 0.132232 0.389161 2.468541
O -1.105767 -3.763708 1.087292
N -0.530954 -2.246886 -0.574928
N -0.499250 -1.653007 1.755241
C -0.154277 0.184397 0.055985
C 1.136342 1.013222 -0.190378
C 2.421188 0.196933 -0.012480
C -1.377562 1.087655 -0.108044
C -0.175501 -0.933589 -0.999110
C -0.139403 -0.301094 1.512325
C 3.658533 1.070159 -0.264227
C 4.954663 0.266123 -0.088938
C -1.594619 2.111300 0.830692
C -2.271054 0.939062 -1.177230
C -0.751357 -2.649165 0.771678
C -0.639452 -3.317362 -1.607917
C 6.189183 1.129284 -0.338312
C -2.695139 2.960534 0.707234
C -3.373097 1.792781 -1.296182
C -3.590301 2.802587 -0.356069
H 1.142539 1.882822 0.500241
H 1.089540 1.433853 -1.218526
H 2.470192 -0.227232 1.010064
H 2.430688 -0.664905 -0.709143
H 3.619081 1.497850 -1.285134
H 3.659378 1.935562 0.426779
H 4.998452 -0.161365 0.932142
H 4.958529 -0.599071 -0.780771
H -0.580281 -1.955250 2.741180
H -0.904786 2.245484 1.670362
H -2.121155 0.175494 -1.942203
H -0.868828 -2.871747 -2.593388
H -1.441077 -4.028984 -1.338580
H 0.310780 -3.871930 -1.689157
H 6.197860 1.538970 -1.354891
H 7.109930 0.548460 -0.211845
H 6.238311 1.975577 0.356450
H -2.854984 3.748327 1.443065
H -4.062125 1.667169 -2.131134
H -4.449743 3.464411 -0.450869


%chk=000181416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181416

0 1
O 0.276030 -0.952074 -2.090797
O 0.379215 0.254649 2.537303
O -1.649875 -3.671026 1.169731
N -0.762482 -2.275547 -0.506048
N -0.684887 -1.650395 1.790191
C -0.061834 0.085384 0.110830
C 1.212003 0.949943 -0.157004
C 2.552815 0.205410 0.022396
C -1.331828 0.987438 -0.084458
C -0.131427 -1.074008 -0.904973
C -0.068853 -0.409813 1.566909
C 3.760315 1.118645 -0.288871
C 5.119490 0.404201 -0.112257
C -1.732848 1.870382 0.952286
C -2.038059 1.009408 -1.314388
C -1.087692 -2.598681 0.831870
C -1.014118 -3.298070 -1.550694
C 6.323327 1.314290 -0.437418
C -2.828057 2.741627 0.766839
C -3.134011 1.882993 -1.494323
C -3.537508 2.750070 -0.455305
H 1.171234 1.814718 0.530026
H 1.132235 1.334094 -1.189980
H 2.640441 -0.165938 1.062908
H 2.587799 -0.674507 -0.650715
H 3.677526 1.494654 -1.329790
H 3.727907 2.010804 0.370833
H 5.203683 0.034402 0.929988
H 5.145859 -0.492855 -0.764223
H -0.820302 -1.935008 2.765856
H -1.187325 1.885630 1.901635
H -1.727317 0.367316 -2.144228
H -1.611554 -2.855781 -2.363541
H -1.556166 -4.131740 -1.083028
H -0.058735 -3.650340 -1.972430
H 6.276951 1.673936 -1.482740
H 7.282275 0.780042 -0.306223
H 6.338790 2.202781 0.221872
H -3.123802 3.414993 1.578934
H -3.667825 1.886432 -2.451175
H -4.388691 3.424945 -0.597000


