%chk=000180717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180717

0 1
O -0.198139 -3.685415 1.318286
O -5.628573 -1.085931 -0.657329
O -6.228880 1.056728 0.165186
O 5.608480 -0.820694 -0.353299
O 4.919074 2.002224 0.052397
N -0.425903 -1.465061 -0.656007
C 0.857552 -1.984337 -0.079579
C -0.778245 -0.143841 -0.164180
C 1.963403 -0.953083 -0.053184
C 0.200974 0.764369 0.248912
C 1.622304 0.408125 0.109933
C -2.172848 0.179188 -0.065821
C 0.567854 -2.479395 1.361376
C -2.538608 1.454890 0.451386
C -0.195005 2.016780 0.792676
C -0.430162 -1.514147 -2.151227
C 3.299099 -1.344776 -0.176321
C 2.635186 1.379265 0.101319
C -1.523147 2.356616 0.882421
C -3.188405 -0.769839 -0.460708
C 4.307729 -0.376096 -0.155091
C 3.971246 0.991581 -0.034289
C -3.925070 1.846402 0.560248
C -4.479988 -0.370625 -0.343463
C -4.849230 0.935791 0.161279
C -6.759019 -0.212430 -0.342015
C 6.495325 -0.564045 0.772008
C 5.762645 2.130913 -1.126319
H 1.167167 -2.877062 -0.688856
H 0.034152 -1.723115 1.963814
H 1.497581 -2.784457 1.876464
H 0.574535 2.709027 1.139001
H 0.417278 -0.985121 -2.615240
H -1.361638 -1.069918 -2.539678
H -0.405868 -2.569198 -2.469199
H 3.575637 -2.393762 -0.286806
H 2.403258 2.440663 0.194322
H -1.819311 3.322369 1.291270
H -2.908670 -1.760467 -0.816691
H -4.190612 2.825459 0.947763
H -1.053270 -3.517502 0.859135
H -7.334786 -0.682542 0.466462
H -7.294877 -0.002023 -1.277051
H 7.467393 -0.875395 0.375251
H 6.192209 -1.187971 1.617158
H 6.486955 0.498963 1.038178
H 5.159965 2.509381 -1.956371
H 6.230746 1.172442 -1.378771
H 6.502307 2.869973 -0.800650


%chk=000180717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180717

0 1
O -0.577592 -3.446778 1.297248
O -5.665379 -1.102902 -0.736252
O -6.292812 1.078651 0.031608
O 5.708810 -0.826028 -0.341397
O 5.024199 1.992423 0.105776
N -0.390549 -1.452485 -0.663779
C 0.871793 -1.999220 -0.077278
C -0.774015 -0.163312 -0.137498
C 1.995086 -0.975890 -0.072061
C 0.218093 0.745551 0.312893
C 1.648578 0.387793 0.169586
C -2.173894 0.174380 -0.071586
C 0.553101 -2.524738 1.351674
C -2.558935 1.484215 0.424973
C -0.195491 2.011144 0.844479
C -0.484072 -1.591002 -2.144882
C 3.342939 -1.349266 -0.241382
C 2.690774 1.350974 0.208430
C -1.537668 2.377356 0.884730
C -3.192754 -0.768656 -0.465719
C 4.376534 -0.392818 -0.159620
C 4.037143 0.978659 0.038641
C -3.948413 1.861479 0.489823
C -4.509964 -0.362972 -0.384557
C -4.885248 0.934282 0.078271
C -6.817619 -0.269338 -0.307990
C 6.608256 -0.581933 0.812393
C 5.773248 2.201207 -1.156230
H 1.146468 -2.877242 -0.690989
H 0.344476 -1.672564 2.032315
H 1.411056 -3.093281 1.747434
H 0.560653 2.704243 1.227220
H 0.334859 -1.053260 -2.668752
H -1.442392 -1.177913 -2.497794
H -0.439983 -2.659733 -2.419092
H 3.620813 -2.395015 -0.414691
H 2.481017 2.417309 0.333722
H -1.830794 3.354633 1.284332
H -2.922713 -1.774363 -0.793273
H -4.239318 2.847710 0.860869
H -1.227015 -3.017377 0.671723
H -7.270540 -0.717729 0.595601
H -7.524859 -0.177458 -1.146501
H 7.601000 -0.926722 0.485759
H 6.271514 -1.173705 1.684406
H 6.634106 0.490647 1.074794
H 5.088872 2.561327 -1.947691
H 6.266187 1.267965 -1.483657
H 6.522246 2.974651 -0.927929


