%chk=000230352.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230352

0 1
O 4.428660 0.635370 0.550448
O -0.892611 3.081318 -0.269078
N 3.232132 0.124617 -1.330521
N -1.081599 1.400161 1.265160
C 1.878742 2.738880 -0.618329
C 3.388347 2.485491 -0.593245
C 1.164621 2.140741 0.600037
C 3.733040 1.024933 -0.371988
C -0.338558 2.264307 0.449201
C 3.177394 -1.320614 -0.994826
C -2.560390 1.371841 1.160819
C 1.966453 -1.608532 -0.135109
C -3.027855 0.266672 0.242677
C 2.060655 -1.470150 1.258026
C -2.834775 0.390329 -1.141857
C 0.744114 -1.964235 -0.720152
C -3.651394 -0.875575 0.761302
C 0.938856 -1.693903 2.059418
C -3.262059 -0.625351 -1.999263
C -0.378374 -2.178555 0.085573
C -4.080441 -1.888935 -0.102280
C -0.282381 -2.046340 1.474345
C -3.885134 -1.766648 -1.481020
H 1.429364 2.340935 -1.550674
H 1.683762 3.833049 -0.657598
H 3.857553 2.854405 -1.527956
H 3.863904 3.075275 0.222407
H 1.466238 1.082569 0.754450
H 1.482074 2.668481 1.525728
H 3.163262 -1.906482 -1.939816
H 4.119478 -1.603131 -0.460296
H -2.980055 1.261023 2.185898
H -2.918726 2.363050 0.777871
H 2.521799 0.438161 -1.988111
H -0.653713 0.575377 1.681851
H 3.014151 -1.179597 1.708783
H -2.352245 1.286545 -1.540160
H 0.662643 -2.074201 -1.799751
H -3.809739 -0.976511 1.832954
H 1.019024 -1.600526 3.141598
H -3.115590 -0.526129 -3.073696
H -1.334524 -2.440968 -0.371065
H -4.570954 -2.773069 0.301539
H -1.156948 -2.225090 2.097393
H -4.222698 -2.554490 -2.151585


%chk=000230352-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230352

0 1
O 4.494982 0.786865 0.569908
O -0.901256 3.569940 0.321254
N 3.200816 0.182949 -1.263898
N -1.010916 1.359929 1.057121
C 1.833200 2.810201 -0.660480
C 3.369135 2.580090 -0.701722
C 1.208421 2.360779 0.683701
C 3.754817 1.123840 -0.405945
C -0.315878 2.495994 0.670212
C 3.250012 -1.268306 -0.969539
C -2.483412 1.314683 1.109460
C 2.072731 -1.697483 -0.094601
C -3.073977 0.247598 0.193809
C 2.163765 -1.594939 1.318773
C -2.826408 0.285776 -1.202870
C 0.852403 -2.127759 -0.675720
C -3.877134 -0.794433 0.717723
C 1.050148 -1.909205 2.131782
C -3.368436 -0.699526 -2.055799
C -0.265763 -2.433420 0.133439
C -4.422012 -1.784604 -0.133556
C -0.168299 -2.324642 1.541113
C -4.167233 -1.740991 -1.523223
H 1.338549 2.270538 -1.493870
H 1.610449 3.880370 -0.818574
H 3.764729 2.886776 -1.689781
H 3.868762 3.197492 0.063949
H 1.507013 1.322588 0.919742
H 1.605396 3.002503 1.494166
H 3.250751 -1.816460 -1.928650
H 4.206881 -1.454593 -0.453982
H -2.815486 1.142421 2.151695
H -2.817284 2.326569 0.811401
H 2.547480 0.501947 -1.981956
H -0.494238 0.502440 1.271846
H 3.103610 -1.254799 1.768332
H -2.211332 1.094999 -1.614339
H 0.771900 -2.218128 -1.766835
H -4.079935 -0.830363 1.795739
H 1.134821 -1.836196 3.221943
H -3.178276 -0.653865 -3.134285
H -1.209565 -2.745158 -0.327220
H -5.044477 -2.583670 0.284992
H -1.032043 -2.570345 2.169289
H -4.591908 -2.503906 -2.185441


