%chk=000256947.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256947

0 1
O 1.612108 -1.271312 0.005636
O -0.634193 0.940762 -1.591335
O 2.306600 -0.111070 1.812707
N -1.181362 0.414360 0.550813
N -2.089278 -2.302608 -1.301432
C 1.226571 1.062373 -0.074831
C 1.367787 2.355623 0.758269
C 2.017696 1.152967 -1.407557
C -0.256978 0.802087 -0.439560
C -2.526791 -0.117590 0.124273
C 1.789265 -0.121611 0.717841
C 0.630761 3.542158 0.153817
C 3.517527 1.328323 -1.215444
C -0.821401 0.316101 1.982738
C -3.277597 0.922946 -0.715884
C -3.398878 -0.553020 1.314111
C -2.276354 -1.341162 -0.692786
C 2.072956 -2.535647 0.605387
C 1.402194 -3.591707 -0.243019
H 1.005955 2.168566 1.796702
H 2.448363 2.592392 0.867506
H 1.601773 1.989405 -2.008421
H 1.813373 0.236055 -2.004689
H -0.455576 3.388645 0.132226
H 0.821122 4.457147 0.727179
H 0.946902 3.733468 -0.880753
H 3.973701 0.467762 -0.711000
H 3.756186 2.221531 -0.624367
H 4.021028 1.435937 -2.184623
H -0.529555 -0.711283 2.260024
H -1.660616 0.634407 2.624191
H 0.018366 0.996824 2.239873
H -2.734044 1.156305 -1.651632
H -4.273503 0.570148 -1.003423
H -3.392164 1.868084 -0.174516
H -2.940646 -1.353574 1.907717
H -4.365192 -0.939907 0.959291
H -3.621573 0.286848 1.983519
H 3.173202 -2.536973 0.531200
H 1.764523 -2.551352 1.664584
H 1.582920 -4.598592 0.149324
H 0.312013 -3.438116 -0.295732
H 1.756109 -3.562297 -1.283521


%chk=000256947-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256947

0 1
O 1.546135 -1.367558 0.166057
O -0.683360 0.793032 -1.669626
O 2.657420 0.018849 1.668711
N -1.208748 0.291322 0.525521
N -2.663280 -1.945660 -1.773401
C 1.188654 1.003904 -0.091581
C 1.243802 2.337658 0.724803
C 1.994020 1.116010 -1.439990
C -0.292471 0.661009 -0.469880
C -2.628743 0.015898 0.061590
C 1.868976 -0.123793 0.702944
C 0.700973 3.567912 -0.031288
C 3.474554 1.515076 -1.277427
C -0.827940 -0.094874 1.898254
C -3.291283 1.311922 -0.490369
C -3.518263 -0.536699 1.213320
C -2.601876 -1.043178 -0.995208
C 2.213652 -2.560553 0.777199
C 1.660562 -3.785725 0.057355
H 0.678786 2.220756 1.668584
H 2.292560 2.504658 1.028112
H 1.464821 1.842051 -2.079122
H 1.912161 0.144740 -1.958602
H -0.339595 3.415796 -0.370764
H 0.716187 4.452627 0.630814
H 1.309664 3.808166 -0.920564
H 4.029246 0.821270 -0.619716
H 3.588200 2.531763 -0.859951
H 3.968969 1.507099 -2.265726
H -0.748869 -1.193624 2.009317
H -1.560379 0.283859 2.628746
H 0.141657 0.342216 2.166388
H -2.737988 1.693914 -1.358579
H -4.331659 1.099293 -0.792727
H -3.302836 2.074124 0.309026
H -3.105252 -1.451259 1.668313
H -4.505980 -0.786745 0.792046
H -3.667643 0.228490 1.994333
H 3.305267 -2.446319 0.648488
H 1.995093 -2.563512 1.861058
H 2.120912 -4.701827 0.470394
H 0.566390 -3.857834 0.179967
H 1.880806 -3.740850 -1.022417


