%chk=000236252.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236252

0 1
O 1.849000 -1.696967 -0.885001
N -1.125296 2.133112 0.029397
C 1.700852 -0.477021 -0.125151
C 0.208170 -0.035799 -0.347214
C 2.069982 -0.788420 1.348155
C 2.755082 0.539696 -0.625102
C 3.518568 -0.325416 1.565033
C 3.986721 0.375264 0.273659
C -0.021444 1.248899 0.525936
C -0.073897 0.357925 -1.825154
C -0.670145 -1.201712 0.114899
C 0.612241 -0.460095 -2.913179
C -1.230787 -1.238451 1.403192
C -0.900868 -2.297994 -0.732984
C -2.485781 1.553655 0.283595
C -0.999814 3.504751 0.632397
C -2.022869 -2.313138 1.815939
C -1.692865 -3.372713 -0.325480
C -3.542489 2.306882 -0.527511
C 0.136196 4.274679 -0.044237
C -2.264012 -3.382923 0.950764
H 1.945635 -1.868987 1.543223
H 1.388491 -0.288404 2.055357
H 2.357797 1.570692 -0.569772
H 2.981885 0.358828 -1.691596
H 3.581579 0.361724 2.426128
H 4.174708 -1.178034 1.808218
H 4.763138 -0.223484 -0.233535
H 4.451419 1.350220 0.495279
H 0.918854 1.854460 0.484579
H -0.153150 0.962022 1.594117
H -1.172769 0.330115 -1.980236
H 0.200492 1.425616 -1.968001
H 2.736224 -2.078273 -0.742689
H 0.463459 -1.543231 -2.760612
H 0.226179 -0.198844 -3.902558
H 1.698717 -0.304442 -2.916763
H -1.052422 -0.418058 2.100829
H -0.422970 -2.321135 -1.721113
H -2.477744 0.490001 -0.049150
H -2.759524 1.548303 1.359983
H -1.956072 4.050068 0.460103
H -0.846181 3.480701 1.732425
H -2.450619 -2.315500 2.816230
H -1.860255 -4.207763 -1.003011
H -3.684882 3.332807 -0.169857
H -3.248234 2.372680 -1.583971
H -4.508725 1.794639 -0.479206
H 0.132138 5.326649 0.257497
H 0.033352 4.236297 -1.137612
H 1.119183 3.857273 0.200003
H -2.883349 -4.217654 1.268157


%chk=000236252-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236252

0 1
O 2.179461 -1.789608 -0.489704
N -1.219404 1.920330 0.134240
C 1.908684 -0.468425 0.153518
C 0.455178 -0.048916 -0.333944
C 2.138346 -0.612086 1.716141
C 3.037869 0.524358 -0.292868
C 3.322187 0.318572 2.090679
C 4.144268 0.405523 0.782247
C 0.023360 1.211964 0.543501
C 0.492860 0.413593 -1.832456
C -0.603331 -1.166319 -0.140719
C 0.719020 -0.671368 -2.907323
C -0.438715 -2.263276 0.747161
C -1.842451 -1.083446 -0.836605
C -2.384124 1.592078 1.011695
C -1.035853 3.394524 0.005516
C -1.461255 -3.218902 0.941827
C -2.866945 -2.036373 -0.649415
C -3.748212 1.845753 0.343101
C -0.196345 3.829438 -1.209202
C -2.686313 -3.113358 0.246976
H 2.412006 -1.665570 1.919168
H 1.239107 -0.403129 2.316724
H 2.672057 1.568035 -0.296713
H 3.374699 0.289823 -1.317150
H 2.951533 1.327533 2.358030
H 3.903209 -0.060560 2.950179
H 4.741368 -0.519684 0.641577
H 4.850227 1.254404 0.763221
H 0.859009 1.937243 0.515437
H -0.071440 0.884205 1.599639
H -0.460185 0.939310 -2.026500
H 1.271664 1.192097 -1.938027
H 3.121434 -2.031368 -0.293294
H -0.069597 -1.442886 -2.868641
H 0.698666 -0.212799 -3.914843
H 1.682395 -1.187168 -2.767195
H 0.507684 -2.407525 1.267877
H -2.016204 -0.250847 -1.524461
H -2.318157 0.521065 1.265664
H -2.327536 2.159777 1.976450
H -2.040103 3.844292 -0.092316
H -0.588067 3.824786 0.939150
H -1.292036 -4.055838 1.629844
H -3.806160 -1.934874 -1.206164
H -3.909450 2.910947 0.096876
H -3.825746 1.261517 -0.589868
H -4.565076 1.533416 1.020080
H -0.139505 4.933436 -1.251068
H -0.651350 3.464169 -2.146080
H 0.837713 3.443150 -1.161050
H -3.477544 -3.857513 0.393487


