%chk=000220709.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220709

0 1
O 7.333145 -1.532658 -2.287196
O -3.029653 2.708008 -1.690702
O -0.990946 2.858146 -1.000718
O -5.108242 -2.594161 0.649908
O -5.850149 -0.979920 -0.586907
N 0.066307 1.031243 0.487812
N 1.067434 0.419920 1.226016
N -2.077945 2.275202 -1.070691
N -4.980470 -1.528557 0.069238
C 4.642510 -0.540310 0.187793
C 4.640951 0.360655 1.429683
C 6.007223 -0.528269 -0.507037
C 3.285248 0.350950 2.147300
C 6.013414 -1.447525 -1.732418
C 2.217349 1.022187 1.327825
C -1.159640 0.403395 0.388178
C -2.216859 1.006650 -0.372967
C -1.416988 -0.853185 1.031316
C -3.468855 0.358113 -0.468045
C -3.678576 -0.855517 0.168758
C -2.636784 -1.466566 0.927473
H 3.853531 -0.214195 -0.517961
H 4.374620 -1.576687 0.476732
H 4.922954 1.394961 1.151439
H 5.424379 0.021208 2.138429
H 6.281654 0.501843 -0.803080
H 6.803341 -0.855917 0.192901
H 2.998183 -0.692436 2.408096
H 3.366623 0.882286 3.121846
H 5.311455 -1.110603 -2.514813
H 5.797075 -2.501039 -1.469506
H 2.501663 1.985553 0.877531
H 0.220123 1.952576 0.005728
H -0.610164 -1.315314 1.612435
H -4.278922 0.829063 -1.055776
H -2.839501 -2.428669 1.418110
H 7.632913 -0.659229 -2.603728


%chk=000220709-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220709

0 1
O 7.205862 -1.622768 -2.456211
O -3.016948 2.782206 -1.689401
O -0.895245 2.935967 -0.877458
O -5.083669 -2.727071 0.492232
O -5.844520 -0.987725 -0.780843
N 0.087532 1.018052 0.589669
N 1.088303 0.391788 1.335527
N -2.039177 2.298332 -1.008121
N -4.932567 -1.575402 -0.078837
C 4.633781 -0.526718 0.232577
C 4.683610 0.434391 1.441350
C 5.968810 -0.571327 -0.545115
C 3.359172 0.474447 2.254897
C 5.920577 -1.535397 -1.745280
C 2.214571 1.052453 1.467656
C -1.128848 0.396919 0.420114
C -2.191242 0.998753 -0.354104
C -1.385198 -0.882982 1.015782
C -3.435041 0.349809 -0.515377
C -3.634613 -0.896666 0.087014
C -2.611469 -1.521038 0.855820
H 3.813355 -0.224508 -0.450817
H 4.379133 -1.546661 0.587129
H 4.935207 1.457767 1.093373
H 5.501797 0.127146 2.121435
H 6.221161 0.450371 -0.902204
H 6.790612 -0.885923 0.127417
H 3.083683 -0.538198 2.600428
H 3.517885 1.101317 3.157318
H 5.101687 -1.242876 -2.439035
H 5.730116 -2.567718 -1.405166
H 2.370746 2.052345 1.012187
H 0.191399 1.947928 0.131682
H -0.580924 -1.333809 1.599582
H -4.224967 0.822385 -1.104684
H -2.810707 -2.495549 1.309175
H 7.434536 -0.728839 -2.816711


