%chk=000297083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297083

0 1
O 0.633981 3.224635 -0.034667
N -1.998513 0.803101 -0.394064
N 2.210703 -0.071114 -0.335160
N -1.646847 3.069323 0.171482
C -0.508554 1.007728 -0.261630
C 0.118716 0.284607 0.945286
C 0.172792 0.590982 -1.577548
C 1.646475 0.452877 0.953426
C 1.698406 0.742634 -1.488060
C -0.370072 2.546307 -0.050722
C -2.718794 2.054730 0.031000
C 3.709579 -0.067135 -0.305555
C -2.599752 -0.452928 -0.074459
C 4.179851 -1.350253 0.414918
C -3.831733 -0.531080 0.606910
C -2.001551 -1.639285 -0.557647
C -4.447121 -1.771801 0.791074
C -2.628210 -2.865965 -0.358994
C -3.853153 -2.942085 0.315633
C 5.615741 -1.460816 0.404060
C 6.816985 -1.558005 0.397007
H -0.123192 -0.798851 0.903387
H -0.309131 0.656099 1.894317
H -0.223166 1.179285 -2.426406
H -0.084719 -0.472460 -1.795081
H 1.909042 1.521948 1.133339
H 2.077646 -0.136831 1.790561
H 2.160083 0.356516 -2.421982
H 1.966039 1.822639 -1.405099
H -3.269836 1.942388 0.997167
H -3.441168 2.326657 -0.776436
H -1.860485 4.053502 0.241938
H 4.140715 0.830310 0.187291
H 4.101826 -0.072474 -1.346260
H 3.798901 -1.367225 1.461945
H 3.715492 -2.239461 -0.076212
H -4.315734 0.359682 0.997832
H -1.053181 -1.591691 -1.102632
H -5.401211 -1.821817 1.315992
H -2.160505 -3.775845 -0.736241
H -4.336140 -3.903796 0.464797
H 7.844895 -1.643432 0.392192


%chk=000297083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297083

0 1
O 0.540049 3.373957 -0.006205
N -1.961766 0.781751 0.060755
N 2.237275 -0.029344 -0.319246
N -1.783194 3.063144 0.168835
C -0.500425 1.078251 -0.040983
C 0.308635 0.497677 1.164780
C 0.102299 0.632034 -1.413179
C 1.833963 0.601082 0.967609
C 1.641109 0.727248 -1.454651
C -0.477611 2.629417 0.038498
C -2.783260 1.999275 0.197756
C 3.706534 -0.178024 -0.448198
C -2.588839 -0.475635 0.051757
C 4.230218 -1.387745 0.376759
C -4.013395 -0.554017 0.172671
C -1.870534 -1.707107 -0.074884
C -4.677720 -1.797281 0.166529
C -2.551338 -2.940104 -0.079155
C -3.958661 -3.006239 0.040882
C 5.685833 -1.572449 0.245487
C 6.905165 -1.717130 0.123454
H 0.039566 -0.562246 1.302753
H 0.014154 1.033511 2.087156
H -0.332156 1.255462 -2.217661
H -0.192434 -0.411071 -1.612893
H 2.151454 1.669902 1.004360
H 2.330295 0.072778 1.801932
H 1.997926 0.277840 -2.400234
H 1.954407 1.797367 -1.441671
H -3.355960 2.004295 1.152033
H -3.510928 2.100898 -0.638090
H -2.017845 4.052785 0.239560
H 4.257629 0.743811 -0.140682
H 3.945667 -0.357311 -1.512229
H 3.977439 -1.253713 1.446319
H 3.697171 -2.295249 0.036025
H -4.615050 0.354609 0.272314
H -0.783121 -1.716531 -0.171472
H -5.769832 -1.815414 0.261079
H -1.966767 -3.862152 -0.178555
H -4.477674 -3.969913 0.036209
H 7.966822 -1.846822 0.021175


