%chk=000296809.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296809

0 1
O 0.680605 3.465005 0.148215
O -1.385524 1.060684 2.456879
O 1.753303 2.923289 -1.768104
O 0.472116 -0.231376 2.353660
N -0.073724 -0.626937 -1.449535
C 1.039394 1.165428 -0.212646
C -0.382025 0.910021 0.348196
C 1.215688 0.098809 -1.360181
C -0.919713 -0.220292 -0.553876
C 2.350964 -0.860622 -1.079775
C 1.218824 2.566679 -0.746908
C -0.328611 0.479151 1.796851
C -2.285072 -0.751488 -0.410256
C 3.377858 -0.996959 -2.024866
C 2.387418 -1.611551 0.104203
C -3.256941 -0.071667 0.343008
C -2.623818 -1.957982 -1.050326
C 4.436443 -1.877479 -1.783231
C 3.447257 -2.490700 0.339499
C 4.472834 -2.625150 -0.602287
C -4.548695 -0.591233 0.449818
C -3.917238 -2.472765 -0.937157
C 0.800586 4.874098 -0.189916
C -4.881403 -1.790581 -0.189009
C -1.540979 0.736704 3.866295
H 1.818161 1.004631 0.581018
H -1.026783 1.823668 0.251530
H 1.381527 0.619410 -2.346315
H 3.354313 -0.420889 -2.949255
H 1.590808 -1.509741 0.847523
H -3.010180 0.859722 0.857550
H -1.870693 -2.488957 -1.640051
H 5.232447 -1.981077 -2.518544
H 3.471908 -3.072369 1.259833
H 5.296829 -3.311198 -0.416538
H -5.298945 -0.059182 1.032697
H -4.172987 -3.407181 -1.435215
H -5.890167 -2.192195 -0.103440
H 1.859014 5.151348 -0.222185
H 0.273541 5.361423 0.637271
H 0.320074 5.064802 -1.154776
H -2.220511 1.518850 4.220459
H -0.572073 0.774306 4.376440
H -1.985130 -0.260457 3.944448


%chk=000296809-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296809

0 1
O 2.193490 3.064501 -0.417606
O -1.767652 1.150126 2.688754
O -0.084129 3.480140 -0.671804
O -0.006596 -0.361502 2.518753
N -0.210288 -0.563393 -1.314500
C 0.716595 1.252108 0.070970
C -0.730162 0.910959 0.523954
C 1.013288 0.261719 -1.153734
C -1.130365 -0.238336 -0.439835
C 2.260755 -0.599561 -0.966008
C 0.847719 2.701313 -0.360725
C -0.768446 0.478396 1.985135
C -2.456681 -0.897462 -0.412267
C 3.308183 -0.552283 -1.915785
C 2.380973 -1.458728 0.156653
C -3.529585 -0.375709 0.360668
C -2.671327 -2.067326 -1.194251
C 4.464006 -1.349595 -1.752656
C 3.534008 -2.256028 0.319489
C 4.579018 -2.205318 -0.633958
C -4.790944 -1.010522 0.346365
C -3.928806 -2.699781 -1.200857
C 2.470757 4.445183 -0.886270
C -4.995438 -2.173180 -0.430596
C -1.903918 0.783140 4.121797
H 1.452928 1.050187 0.864794
H -1.398870 1.779709 0.385349
H 1.136713 0.839510 -2.090386
H 3.219706 0.109779 -2.786179
H 1.579535 -1.497419 0.904406
H -3.387739 0.526233 0.964327
H -1.836677 -2.454966 -1.786404
H 5.269564 -1.303574 -2.494218
H 3.618472 -2.917475 1.189140
H 5.473027 -2.826054 -0.505182
H -5.614141 -0.596122 0.938838
H -4.082077 -3.601423 -1.804072
H -5.974776 -2.664768 -0.438162
H 2.045643 4.601819 -1.891816
H 3.566764 4.519593 -0.900051
H 2.030180 5.177684 -0.189378
H -2.697198 1.439617 4.504694
H -0.951253 0.956334 4.649003
H -2.183561 -0.279523 4.214613


