%chk=000231956.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231956

0 1
O 5.346851 3.575395 -0.470230
O 0.474494 -6.390733 0.326093
O -6.346419 1.282977 -0.288016
N -0.023841 0.033200 0.000512
C 1.047740 0.989137 -0.007159
C 0.255064 -1.358427 0.225552
C -1.375055 0.467694 -0.223125
C 0.841719 2.275406 0.535116
C 1.262299 -1.730816 1.140325
C -1.634087 1.497763 -1.151649
C 2.298367 0.638477 -0.553667
C -0.478804 -2.342035 -0.466421
C -2.432589 -0.136132 0.485335
C 1.884420 3.197599 0.526367
C 1.528830 -3.080602 1.353289
C -2.945127 1.916007 -1.362288
C 3.330856 1.572616 -0.551353
C -0.201124 -3.687449 -0.238309
C -3.737978 0.293523 0.260551
C 3.133982 2.855481 -0.013731
C 0.801807 -4.067071 0.669035
C -4.004568 1.320131 -0.660529
C 4.250189 3.836137 -0.021951
C 1.082925 -5.508858 0.894827
C -5.405250 1.764240 -0.882918
H -0.122100 2.543816 0.967730
H 1.823393 -0.970824 1.684104
H -0.817504 1.956366 -1.709266
H 2.457762 -0.350374 -0.984523
H -1.251748 -2.058311 -1.181134
H -2.235396 -0.927340 1.209247
H 1.724506 4.191230 0.949808
H 2.307213 -3.367413 2.063319
H -3.144697 2.710324 -2.084338
H 4.309875 1.319931 -0.974506
H -0.759073 -4.467692 -0.768809
H -4.574110 -0.161333 0.804177
H 4.024796 4.826196 0.407209
H 1.884759 -5.735845 1.616419
H -5.543882 2.565406 -1.627296


%chk=000231956-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231956

0 1
O 5.416317 3.667421 -0.505732
O 0.512857 -6.502442 0.345673
O -6.451807 1.330153 -0.310758
N -0.024981 0.030455 -0.003110
C 1.046318 0.984705 -0.006892
C 0.252551 -1.358609 0.225205
C -1.373785 0.466640 -0.224721
C 0.863343 2.271796 0.571324
C 1.254458 -1.745786 1.158212
C -1.648588 1.493954 -1.170067
C 2.303039 0.651368 -0.592844
C -0.471914 -2.362260 -0.482912
C -2.449341 -0.125400 0.500593
C 1.916765 3.202100 0.560455
C 1.523590 -3.108276 1.373629
C -2.971877 1.917552 -1.380788
C 3.349417 1.584637 -0.595823
C -0.199797 -3.719203 -0.257646
C -3.766914 0.301222 0.280907
C 3.171174 2.872998 -0.018947
C 0.801907 -4.111294 0.673412
C -4.046542 1.328905 -0.662335
C 4.269149 3.866451 -0.019596
C 1.099228 -5.541703 0.915544
C -5.434141 1.788876 -0.898671
H -0.095211 2.526471 1.033219
H 1.803818 -0.979440 1.713035
H -0.827505 1.940565 -1.738699
H 2.439537 -0.332710 -1.051795
H -1.232191 -2.066189 -1.212215
H -2.237421 -0.905705 1.237922
H 1.774083 4.189790 1.016543
H 2.290940 -3.401901 2.100788
H -3.180283 2.702407 -2.118665
H 4.316732 1.348429 -1.052538
H -0.740072 -4.501947 -0.801207
H -4.603180 -0.135723 0.837461
H 4.013205 4.847620 0.456218
H 1.909728 -5.731111 1.665063
H -5.534115 2.602980 -1.661445


