%chk=000200340.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200340

0 1
O 2.095940 0.108415 -0.454285
O 3.085170 -1.060075 1.206748
N -3.536537 -0.084210 0.116879
C -2.099345 -0.096470 -0.349559
C -1.421754 1.235536 0.056972
C -1.339376 -1.262883 0.327243
C 0.049221 1.259202 -0.364640
C 0.133299 -1.276664 -0.089241
C 0.792863 0.064979 0.237932
C -4.305825 1.042498 -0.516015
C -4.228060 -1.385173 -0.182460
C -5.722135 1.107284 0.079684
C -5.643514 -1.374649 0.419281
C -6.472582 -0.211840 -0.138646
C 3.176132 -0.500572 0.139224
C 4.368710 -0.340366 -0.761730
C 5.660243 -0.223685 0.055023
C 6.893080 -0.172762 -0.856213
C 8.179965 -0.044551 -0.045062
H -2.030591 -0.215420 -1.461360
H -1.514442 1.373366 1.153411
H -1.951620 2.096172 -0.396212
H -1.805458 -2.234194 0.071576
H -1.428938 -1.170585 1.428908
H 0.143022 1.235828 -1.469104
H 0.529081 2.204454 -0.047506
H 0.672073 -2.094089 0.431033
H 0.232285 -1.488761 -1.171473
H 0.981635 0.180848 1.326425
H -4.363323 0.949867 -1.621946
H -3.775425 1.996220 -0.297800
H -3.643331 -2.209881 0.282291
H -4.280261 -1.598636 -1.271751
H -6.277119 1.949620 -0.370205
H -5.651895 1.319060 1.165857
H -5.570205 -1.282817 1.521929
H -6.141095 -2.339639 0.216217
H -7.461154 -0.175728 0.354613
H -6.670904 -0.365530 -1.215868
H 4.413650 -1.216562 -1.444795
H 4.236009 0.542539 -1.423796
H 5.621988 0.680158 0.694843
H 5.736822 -1.080034 0.757785
H 6.809086 0.677958 -1.560873
H 6.937604 -1.084231 -1.484503
H 8.189555 0.870610 0.558386
H 8.311214 -0.889147 0.641828
H 9.059040 -0.014964 -0.698845


%chk=000200340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200340

0 1
O 2.139441 0.416169 -0.592686
O 3.069297 -0.854536 1.132546
N -3.595153 -0.056727 0.074240
C -2.179931 -0.002069 -0.421717
C -1.512979 1.325331 0.038836
C -1.312348 -1.190821 0.065452
C -0.055849 1.457917 -0.463362
C 0.150364 -1.069904 -0.428710
C 0.773815 0.263032 0.015705
C -4.476922 0.856671 -0.705258
C -4.202101 -1.413670 0.136344
C -5.875594 0.983704 -0.069904
C -5.596927 -1.367808 0.797499
C -6.543507 -0.403280 0.050744
C 3.202767 -0.211077 0.064854
C 4.498018 -0.001926 -0.704320
C 5.756884 -0.330753 0.122806
C 7.053171 -0.202146 -0.707316
C 8.318648 -0.523250 0.116739
H -2.165826 -0.026956 -1.546366
H -1.543505 1.347575 1.146189
H -2.091664 2.198641 -0.311502
H -1.717100 -2.151472 -0.300131
H -1.336496 -1.224147 1.173863
H -0.032695 1.488833 -1.570582
H 0.392966 2.400623 -0.099977
H 0.749207 -1.913037 -0.040016
H 0.177005 -1.118541 -1.535769
H 0.894811 0.271544 1.116512
H -4.588052 0.487928 -1.761361
H -4.007636 1.853740 -0.759420
H -3.552676 -2.075173 0.732182
H -4.298111 -1.866689 -0.887810
H -6.495649 1.666864 -0.682379
H -5.770528 1.434513 0.935845
H -5.477070 -1.028103 1.844755
H -6.019298 -2.391238 0.822939
H -7.515680 -0.327451 0.573707
H -6.751083 -0.801282 -0.964500
H 4.456072 -0.647072 -1.606299
H 4.519477 1.037685 -1.080994
H 5.808111 0.342897 1.000633
H 5.668583 -1.355872 0.529655
H 7.129794 0.825568 -1.118019
H 6.998493 -0.883222 -1.581628
H 8.413977 0.162666 0.979449
H 8.281399 -1.555356 0.513088
H 9.234877 -0.427827 -0.494360


