%chk=000235980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235980

0 1
O -0.099387 0.675028 -2.160364
O 2.076759 1.190379 -0.676755
N -5.536011 1.992474 0.805301
N 0.764939 -5.048510 0.476487
C -0.181371 0.513657 -0.727286
C 0.788303 1.560824 -0.081143
C -1.608078 0.860438 -0.344202
C 0.141253 -0.933728 -0.399408
C 0.466345 2.987996 -0.480745
C -2.092629 0.544488 0.932810
C -0.598023 -1.929185 -1.062483
C -2.456025 1.502057 -1.257060
C 1.126749 -1.326337 0.512077
C -4.253077 1.528353 0.386107
C 0.620471 -3.676837 0.112243
C -3.394566 0.871522 1.300000
C -0.367457 -3.278311 -0.820610
C -3.762258 1.831232 -0.905406
C 1.369219 -2.674649 0.769980
C 3.244015 1.614015 -0.088626
C 3.335307 2.309641 1.123282
C 4.390474 1.250603 -0.827455
C -6.164701 1.261485 1.940993
C -6.524658 2.270649 -0.273631
C 0.302350 -6.052342 -0.521936
C 2.070731 -5.440832 1.076316
C 4.607533 2.645905 1.600166
C 5.639758 1.598959 -0.326364
C 5.754799 2.296393 0.886474
H 0.840508 1.429759 1.019404
H 0.328083 3.064979 -1.571201
H 1.269893 3.680703 -0.206328
H -0.463965 3.336481 -0.013576
H -1.448574 0.026308 1.645138
H -1.361410 -1.627371 -1.784854
H -2.081549 1.736922 -2.258279
H 1.734627 -0.579271 1.025214
H 0.831001 0.513642 -2.449149
H -3.740570 0.622379 2.300098
H -0.963123 -4.020426 -1.345888
H -4.394009 2.333092 -1.633833
H 2.138266 -2.942501 1.490063
H 2.450624 2.588298 1.685532
H 4.276017 0.710380 -1.763113
H -5.488494 1.284799 2.813997
H -6.405591 0.211299 1.713925
H -7.091292 1.777207 2.241090
H -6.105503 3.015070 -0.973765
H -7.430035 2.720223 0.165452
H -6.819340 1.378209 -0.847336
H -0.760196 -5.869843 -0.762450
H 0.361410 -7.061191 -0.082259
H 0.879313 -6.044167 -1.459752
H 2.264811 -4.824291 1.972009
H 2.924306 -5.335729 0.388634
H 2.019315 -6.488398 1.414641
H 4.697209 3.188064 2.541517
H 6.538374 1.328659 -0.880961
H 6.737130 2.563247 1.265671


%chk=000235980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235980

0 1
O -0.131920 0.699643 -2.351794
O 2.086534 1.273531 -0.849902
N -5.633914 1.757308 0.782969
N 1.026387 -5.078823 0.262129
C -0.200047 0.505256 -0.882798
C 0.758750 1.556692 -0.229435
C -1.649087 0.804733 -0.469414
C 0.189770 -0.947140 -0.545242
C 0.367534 3.013048 -0.507329
C -2.114019 0.453666 0.821536
C -0.408221 -1.986532 -1.304495
C -2.546317 1.470468 -1.337260
C 1.075391 -1.329713 0.490068
C -4.330495 1.443744 0.372473
C 0.752559 -3.729759 -0.000842
C -3.419601 0.765623 1.244158
C -0.141231 -3.341831 -1.050753
C -3.859863 1.781131 -0.936054
C 1.355347 -2.683931 0.764006
C 3.264472 1.639474 -0.183785
C 3.313131 2.288099 1.077143
C 4.467275 1.305999 -0.857309
C -6.089119 1.386507 2.126334
C -6.550940 2.431473 -0.141527
C 0.400233 -6.126813 -0.550461
C 1.943406 -5.441372 1.347169
C 4.569525 2.589831 1.653206
C 5.709741 1.616510 -0.271243
C 5.771461 2.260314 0.989695
H 0.816497 1.366626 0.860001
H 0.182934 3.150940 -1.585907
H 1.175093 3.698298 -0.196005
H -0.551443 3.281558 0.040219
H -1.455376 -0.098686 1.502915
H -1.095548 -1.713421 -2.112555
H -2.204453 1.731264 -2.342776
H 1.585469 -0.575073 1.098952
H 0.822854 0.575351 -2.595415
H -3.733711 0.466422 2.248269
H -0.628881 -4.100695 -1.669564
H -4.520088 2.286815 -1.646662
H 2.054558 -2.921301 1.570850
H 2.398640 2.568288 1.607795
H 4.403144 0.801400 -1.826401
H -5.465248 1.852979 2.916750
H -6.069146 0.287818 2.285052
H -7.126164 1.729632 2.269958
H -6.162352 3.420756 -0.460664
H -7.520081 2.594686 0.356540
H -6.735352 1.830389 -1.056331
H -0.706789 -6.105718 -0.473678
H 0.743864 -7.114431 -0.203411
H 0.666208 -6.032498 -1.623763
H 1.586214 -5.071052 2.330569
H 2.962731 -5.033622 1.183096
H 2.024344 -6.538425 1.408763
H 4.601202 3.091877 2.627112
H 6.633326 1.353397 -0.799236
H 6.738812 2.501188 1.442688


