%chk=000187931.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187931

0 1
O -0.683746 -1.950389 -1.318407
N -0.552972 -0.772954 -0.952111
N 0.534056 -0.173692 -0.627895
C -4.101869 0.397649 -0.273945
C -5.350969 -0.093864 0.263310
C 4.204606 -0.477453 -0.159484
C 5.294554 0.320643 0.356739
C -2.968987 -0.466044 -0.344815
C 2.879308 0.035371 -0.139614
C -4.016301 1.743791 -0.726770
C -5.452625 -1.436029 0.722154
C 4.471212 -1.774430 -0.684104
C -6.484370 0.763194 0.336794
C 5.041636 1.616011 0.885835
C 6.624236 -0.187297 0.337443
C -1.766426 0.067406 -0.860572
C 1.830412 -0.773975 -0.658127
C -3.111990 -1.833414 0.123312
C -4.282638 -2.290259 0.628394
C 2.655068 1.359901 0.410763
C -5.191073 2.593837 -0.643625
C -2.800472 2.225570 -1.242809
C -6.359705 2.129781 -0.139463
C 3.676513 2.107670 0.895370
C 5.838708 -2.264759 -0.689247
C 6.857919 -1.514817 -0.206725
C -1.684881 1.398284 -1.305573
C 3.410362 -2.545749 -1.181107
C -6.671027 -1.898320 1.245094
C 2.106942 -2.054729 -1.167900
C -7.689363 0.271543 0.864463
C 6.111406 2.380220 1.383081
C 7.671004 0.599839 0.841054
C -7.776683 -1.047881 1.313796
C 7.410579 1.871998 1.358023
H -2.243790 -2.498661 0.035282
H -4.379772 -3.320352 0.976016
H 1.627668 1.733664 0.423374
H -5.096198 3.619424 -1.001612
H -2.729325 3.255201 -1.593991
H -7.241978 2.768486 -0.076109
H 3.501367 3.100549 1.308236
H 6.012626 -3.260599 -1.097105
H 7.883619 -1.882807 -0.211032
H -0.739454 1.786461 -1.699168
H 3.603255 -3.540840 -1.582469
H -6.754186 -2.925824 1.598454
H 1.292082 -2.675378 -1.559117
H -8.561041 0.922484 0.923761
H 5.923899 3.372415 1.789419
H 8.690470 0.218803 0.829640
H -8.717479 -1.417903 1.721783
H 8.232515 2.473128 1.746107


%chk=000187931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187931

0 1
O -0.689555 -2.063610 -1.167377
N -0.553833 -0.810129 -0.748878
N 0.576160 -0.191359 -0.422705
C -4.150846 0.375719 -0.205433
C -5.442176 -0.108591 0.207961
C 4.273396 -0.474176 -0.135288
C 5.372302 0.354116 0.285564
C -3.017834 -0.527401 -0.262006
C 2.925790 0.028048 -0.080052
C -4.001165 1.768901 -0.554515
C -5.613882 -1.489511 0.581731
C 4.531057 -1.811984 -0.611865
C -6.575536 0.784644 0.256949
C 5.129014 1.690552 0.766744
C 6.723874 -0.149313 0.229069
C -1.756652 0.025500 -0.652471
C 1.828834 -0.818990 -0.511795
C -3.222715 -1.910043 0.123693
C -4.464517 -2.361460 0.531913
C 2.708287 1.368551 0.411045
C -5.151452 2.642224 -0.502299
C -2.721868 2.252943 -0.940152
C -6.391525 2.170080 -0.112991
C 3.766231 2.165905 0.816526
C 5.891121 -2.293179 -0.658503
C 6.947755 -1.493979 -0.254848
C -1.615056 1.394568 -0.979281
C 3.432152 -2.617732 -1.019209
C -6.895264 -1.951016 0.988648
C 2.112616 -2.147653 -0.972625
C -7.840648 0.283333 0.668400
C 6.229108 2.494087 1.177848
C 7.794539 0.686393 0.649043
C -7.997240 -1.071376 1.029898
C 7.546710 1.994665 1.118205
H -2.377647 -2.597004 0.064862
H -4.593499 -3.411059 0.821210
H 1.678483 1.729554 0.460176
H -5.017279 3.694562 -0.777486
H -2.604634 3.307182 -1.213644
H -7.257088 2.841757 -0.075035
H 3.579536 3.180392 1.188420
H 6.071723 -3.311190 -1.022664
H 7.976775 -1.870149 -0.295417
H -0.627175 1.760607 -1.267353
H 3.625752 -3.635124 -1.378865
H -7.018651 -3.002748 1.271696
H 1.285577 -2.782493 -1.286804
H -8.698749 0.964630 0.702835
H 6.041281 3.510226 1.543831
H 8.820704 0.303080 0.605262
H -8.978819 -1.441282 1.344769
H 8.383230 2.625236 1.438063


