%chk=000192283.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192283

0 1
O 5.917288 -2.799036 0.627048
O -7.610883 -2.444214 -0.815160
O -7.037938 -2.048437 1.310214
N -2.947953 1.223268 0.457102
C -0.398888 0.636512 0.621075
C 0.837710 1.591325 0.627833
C 1.525379 1.756480 -0.748096
C -1.549766 1.565701 0.088013
C 1.754008 0.420358 -1.495948
C -0.191689 -0.616956 -0.247873
C 0.251838 2.947894 1.093426
C -1.217669 2.978233 0.638372
C 0.405183 -0.312959 -1.620825
C 2.878726 2.481018 -0.617482
C -0.679214 0.167276 2.061524
C 2.858666 -0.411664 -0.881622
C 3.901918 1.665064 0.179130
C 3.881340 0.191375 -0.123219
C -3.477004 0.033563 -0.277719
C 2.909320 -1.796724 -1.120602
C 4.925561 -0.590213 0.400780
C -4.842721 -0.358016 0.305254
C 3.932823 -2.590723 -0.612539
C 4.931682 -1.964986 0.148810
C -5.490903 -1.471882 -0.521746
C -6.733517 -1.980116 0.144140
H 1.586860 1.213189 1.356106
H 0.857258 2.383987 -1.390797
H -1.488762 1.588822 -1.029822
H 2.100080 0.672083 -2.535625
H -1.159332 -1.151264 -0.362802
H 0.482394 -1.318856 0.286569
H 0.816501 3.802923 0.688477
H 0.321713 3.034619 2.191084
H -1.886432 3.256279 1.471365
H -1.387690 3.738421 -0.141105
H 0.529246 -1.251883 -2.194443
H -0.294444 0.309136 -2.213244
H 2.737303 3.468703 -0.138502
H 3.277309 2.691242 -1.629326
H -0.919146 1.008688 2.720573
H -1.511511 -0.541561 2.106963
H 0.194049 -0.337801 2.490429
H -3.027153 1.078965 1.469623
H 3.719364 1.800816 1.268135
H 4.917937 2.072763 -0.003877
H -2.778028 -0.838764 -0.254144
H -3.585991 0.325258 -1.346696
H 2.127009 -2.267072 -1.720691
H 5.712446 -0.131556 0.988585
H -5.506349 0.532748 0.333248
H -4.739887 -0.682713 1.361822
H 3.975733 -3.661240 -0.790774
H -4.789671 -2.325451 -0.658780
H -5.724070 -1.117723 -1.551235
H 6.595299 -2.309196 1.150592
H -8.450434 -2.807199 -0.427196


%chk=000192283-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192283

0 1
O 6.493456 -2.448379 0.334792
O -7.880258 -2.232785 -1.308845
O -7.866856 -0.919114 0.604192
N -2.915650 0.923221 0.668478
C -0.319323 0.477981 0.831777
C 0.873284 1.489823 0.708133
C 1.435748 1.645127 -0.741039
C -1.547461 1.346276 0.330950
C 1.700441 0.286281 -1.453774
C -0.079055 -0.821677 0.015943
C 0.264865 2.837530 1.217490
C -1.261712 2.770780 0.902052
C 0.407757 -0.569129 -1.425532
C 2.737194 2.485170 -0.785326
C -0.525957 0.089121 2.318228
C 2.957933 -0.421437 -0.913392
C 3.884855 1.809456 -0.004983
C 4.000395 0.311900 -0.275319
C -3.536659 -0.216957 -0.021478
C 3.152703 -1.815336 -1.111994
C 5.178787 -0.355912 0.144116
C -5.074635 -0.159010 0.101149
C 4.319864 -2.482537 -0.697316
C 5.340305 -1.741809 -0.061690
C -5.749961 -1.342530 -0.619522
C -7.237311 -1.436509 -0.344099
H 1.696925 1.151673 1.366909
H 0.669628 2.176932 -1.345290
H -1.501724 1.386529 -0.776088
H 1.908125 0.529400 -2.520260
H -1.004251 -1.428623 0.002281
H 0.683462 -1.430851 0.543308
H 0.743927 3.707497 0.733655
H 0.432460 2.952507 2.304031
H -1.865732 2.927169 1.815892
H -1.581393 3.546449 0.184943
H 0.551108 -1.532433 -1.949806
H -0.369112 -0.027331 -2.001737
H 2.569975 3.503516 -0.386314
H 3.035364 2.604536 -1.846423
H -0.736809 0.965752 2.958242
H -1.367439 -0.621653 2.428703
H 0.380273 -0.405591 2.715012
H -3.110648 0.946453 1.676572
H 3.736006 1.965521 1.083471
H 4.844589 2.305681 -0.248728
H -3.193728 -1.217235 0.346713
H -3.245187 -0.163423 -1.090311
H 2.373848 -2.403530 -1.608514
H 5.975383 0.223849 0.633261
H -5.431244 0.801480 -0.312667
H -5.368835 -0.168824 1.168502
H 4.457061 -3.555924 -0.857144
H -5.297965 -2.301532 -0.288554
H -5.597589 -1.299128 -1.713410
H 7.143475 -1.840383 0.766715
H -8.847801 -2.299524 -1.081550


