%chk=000223635.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223635

0 1
O -0.669988 -2.318369 -0.183838
O 4.695344 -0.883438 3.049460
O 6.258338 -1.190403 -1.331783
N 2.963011 -0.767570 0.336822
C -0.173611 3.346486 -0.671773
C -0.370173 1.833177 -0.549172
C 0.656771 -0.388220 -0.473483
C 0.762969 0.996772 -0.591330
C 1.868156 -1.281028 -0.555245
C 0.667241 3.649723 -1.928841
C -1.510270 4.103311 -0.792412
C 0.564948 3.839281 0.589389
C -1.628511 1.251974 -0.378140
C -1.778283 -0.139481 -0.249686
C -0.629679 -0.945723 -0.299277
C 2.591067 -0.922835 1.779807
C 4.259474 -1.448132 0.025524
C -3.122690 -0.722872 -0.065576
C 3.551602 -0.106133 2.657089
C 4.956636 -0.640249 -1.082712
C -4.054250 -0.685470 -1.115149
C -3.473679 -1.314910 1.158387
C -5.324623 -1.239692 -0.939834
C -4.746452 -1.866216 1.326785
C -5.672309 -1.831483 0.279114
H 1.759552 1.432257 -0.711360
H 1.586210 -2.337422 -0.332571
H 2.243069 -1.274051 -1.605999
H 0.779780 4.727716 -2.081782
H 1.675066 3.227213 -1.860206
H 0.198657 3.234431 -2.827457
H -2.140710 3.961535 0.091449
H -1.342003 5.181112 -0.894786
H -2.077774 3.780974 -1.671659
H 0.727308 4.921125 0.558295
H -0.006883 3.615049 1.495883
H 1.545797 3.364502 0.696732
H -2.527888 1.867849 -0.333516
H 1.555416 -0.530140 1.908834
H 2.569808 -1.981395 2.115431
H 4.911580 -1.464568 0.933020
H 4.151521 -2.508173 -0.283714
H 4.010523 0.738322 2.103825
H 3.049491 0.273292 3.563154
H 4.455956 -0.738077 -2.062640
H 5.048772 0.427473 -0.818124
H -1.601706 -2.655364 -0.117755
H -3.781765 -0.224469 -2.063719
H -2.757663 -1.329008 1.978867
H -6.046122 -1.210168 -1.755274
H -5.018544 -2.321049 2.278221
H -6.662972 -2.261904 0.412705
H 4.425731 -1.636916 3.608045
H 6.828253 -1.092848 -0.543922


%chk=000223635-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223635

0 1
O -0.832165 -2.482073 -0.045307
O 5.326481 0.022861 2.627942
O 5.836706 -1.613579 -1.884500
N 3.010198 -0.805239 0.528300
C -0.113118 3.261822 -0.483367
C -0.361568 1.740357 -0.352852
C 0.583962 -0.538002 -0.083420
C 0.741656 0.856517 -0.208004
C 1.785581 -1.473994 0.021114
C 0.783901 3.535564 -1.728148
C -1.428468 4.065399 -0.647355
C 0.615288 3.778372 0.794294
C -1.654020 1.170063 -0.358891
C -1.866412 -0.228078 -0.224681
C -0.729007 -1.075204 -0.103962
C 2.942724 -0.558946 1.985609
C 4.260351 -1.443523 0.042613
C -3.249390 -0.791467 -0.235022
C 3.932700 0.500542 2.502190
C 4.635811 -0.936799 -1.366536
C -4.186860 -0.394040 -1.228188
C -3.672918 -1.726246 0.754771
C -5.498556 -0.914721 -1.237558
C -4.984996 -2.251456 0.741284
C -5.902440 -1.851511 -0.257012
H 1.772551 1.228279 -0.191394
H 1.505904 -2.357445 0.641220
H 2.008273 -1.879330 -0.984712
H 0.990600 4.618707 -1.821601
H 1.752727 3.010235 -1.654922
H 0.284993 3.196014 -2.654420
H -2.096397 3.940349 0.225057
H -1.194814 5.142014 -0.738604
H -1.982064 3.764641 -1.556303
H 0.823860 4.861573 0.706508
H -0.007347 3.616741 1.693615
H 1.578256 3.259022 0.949779
H -2.537969 1.810109 -0.440364
H 1.922023 -0.186811 2.198494
H 3.067034 -1.501628 2.583874
H 5.074627 -1.178114 0.740788
H 4.186401 -2.556716 0.015113
H 3.986145 1.337606 1.787394
H 3.579839 0.885427 3.482646
H 3.851029 -1.173933 -2.104338
H 4.767714 0.164558 -1.336444
H -1.780539 -2.758381 -0.152501
H -3.871904 0.313155 -2.003799
H -2.995295 -1.989587 1.576185
H -6.203529 -0.597015 -2.014039
H -5.293130 -2.960645 1.517897
H -6.919419 -2.258551 -0.267814
H 5.352547 -0.687619 3.318457
H 6.601945 -1.393477 -1.294982


