%chk=000275379.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275379

0 1
O -4.645223 0.209711 0.334203
O -2.633408 1.057316 0.929268
N 2.718740 -0.591496 -0.350640
N 1.709335 -1.479496 -0.602155
C 1.117720 1.342872 -0.404073
C 3.713225 1.603204 -0.169382
C 2.497117 0.690959 -0.327389
C -1.099214 -3.044430 0.506635
C 0.259092 -3.328590 -0.152266
C -1.610043 -1.638498 0.168595
C 1.116303 2.595588 -1.284015
C 0.620677 1.643669 1.013092
C 4.582254 1.538005 -1.429856
C 4.512917 1.230669 1.084441
C 1.309365 -2.335116 0.293794
C -2.984071 -1.370489 0.792083
C 1.749496 -2.400849 1.725206
C -3.325490 0.091504 0.704220
C -5.206650 1.551447 0.178601
C -4.756281 2.146885 -1.138957
H 0.406696 0.610269 -0.875773
H 3.346462 2.656303 -0.044743
H -1.016270 -3.163827 1.604676
H -1.829780 -3.806231 0.170641
H 0.153544 -3.306337 -1.259966
H 0.594806 -4.356382 0.090954
H -1.657350 -1.505605 -0.930969
H -0.884038 -0.874298 0.525209
H 1.454418 2.365147 -2.300722
H 0.106961 3.017314 -1.355264
H 1.770306 3.380945 -0.885661
H 1.146503 2.491562 1.462311
H 0.747582 0.783464 1.678478
H -0.455099 1.884310 1.006285
H 4.962239 0.520127 -1.595221
H 4.013035 1.817552 -2.322788
H 5.445531 2.205806 -1.354602
H 4.914993 0.211141 1.009805
H 3.887935 1.270693 1.982277
H 5.359442 1.908755 1.230119
H -3.769100 -1.985752 0.301552
H -2.996709 -1.668069 1.863268
H 2.825354 -2.180878 1.820653
H 1.215397 -1.658971 2.335099
H 1.577988 -3.384735 2.175977
H -4.902837 2.161977 1.047239
H -6.288892 1.329435 0.210535
H -3.676607 2.359853 -1.129788
H -4.943292 1.461786 -1.975956
H -5.276078 3.087784 -1.353531


%chk=000275379-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275379

0 1
O -4.935055 0.145542 0.517336
O -2.808984 1.105936 0.540711
N 2.848661 -0.586926 -0.188805
N 1.776923 -1.394773 -0.615011
C 1.366310 1.416389 -0.489523
C 3.953371 1.554599 0.091567
C 2.702240 0.721748 -0.212364
C -1.127265 -2.998094 0.380316
C 0.251414 -3.246525 -0.299458
C -1.689290 -1.591260 0.080215
C 1.476897 2.567126 -1.520028
C 0.741955 1.924868 0.842494
C 4.884091 1.596030 -1.153448
C 4.723620 1.025525 1.326995
C 1.338332 -2.320829 0.214449
C -3.065890 -1.350120 0.736369
C 1.825839 -2.477396 1.643025
C -3.539394 0.087149 0.583200
C -5.545213 1.507693 0.392994
C -5.621742 1.933850 -1.075839
H 0.689934 0.644702 -0.906585
H 3.621324 2.589312 0.308442
H -1.032418 -3.136688 1.477247
H -1.838710 -3.771363 0.026709
H 0.155913 -3.099779 -1.390670
H 0.552325 -4.298936 -0.120313
H -1.771152 -1.455065 -1.016149
H -0.983568 -0.817174 0.432047
H 1.852014 2.203004 -2.493471
H 0.479066 3.014396 -1.684354
H 2.148709 3.372717 -1.169853
H 1.342084 2.748162 1.274983
H 0.682556 1.114038 1.591871
H -0.284947 2.291104 0.665203
H 5.222282 0.573582 -1.399521
H 4.366831 2.008054 -2.038368
H 5.773537 2.221780 -0.951575
H 5.047895 -0.014693 1.152829
H 4.087522 1.037489 2.231353
H 5.616023 1.649081 1.522537
H -3.840286 -2.026972 0.334976
H -2.998477 -1.559535 1.824496
H 2.892078 -2.191780 1.703215
H 1.275641 -1.808146 2.334466
H 1.688740 -3.512709 2.000060
H -4.942979 2.218360 0.986104
H -6.543898 1.385174 0.841859
H -4.611515 2.060188 -1.499678
H -6.171082 1.186872 -1.674483
H -6.153262 2.900295 -1.157072


