%chk=000214022.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214022

0 1
N -4.105031 -0.117635 0.001180
C -3.328063 1.081169 -0.475828
C -3.257731 -1.240961 -0.536013
C -2.851651 0.741836 -1.919760
C -2.804981 -0.799158 -1.959696
C -2.122603 1.208927 0.484728
C -2.045277 -1.345145 0.418589
C -1.286912 -0.046605 0.552804
C 0.051883 -0.010876 0.736704
C -5.506477 -0.147076 -0.500613
C 2.378044 0.101469 -0.885343
C 0.930423 -1.201587 0.742887
C 0.856918 1.228821 0.805806
C 2.075137 -1.174287 -0.091180
C 1.999900 1.313860 -0.026760
C 3.863832 0.156691 -1.284125
C 1.508265 0.108141 -2.159038
C 0.678091 -2.312320 1.555887
C 0.539272 2.278728 1.674800
C 2.886287 -2.310062 -0.157813
C 2.740863 2.498472 -0.033307
C 1.516261 -3.430650 1.496834
C 1.308273 3.447208 1.674950
C 2.607534 -3.435579 0.627622
C 2.395876 3.562985 0.808856
H -3.940738 2.005090 -0.445713
H -3.813352 -2.200565 -0.554744
H -1.867151 1.184726 -2.135094
H -3.548516 1.144584 -2.669535
H -3.477413 -1.203967 -2.730385
H -1.795850 -1.169972 -2.196127
H -2.502515 1.428698 1.506650
H -1.515817 2.084960 0.180024
H -1.387084 -2.165960 0.070013
H -2.409685 -1.640059 1.427140
H -6.051680 0.712513 -0.078561
H -5.998073 -1.058669 -0.124311
H -5.612112 -0.122008 -1.594821
H 4.511536 0.153374 -0.399306
H 4.144891 -0.699170 -1.908048
H 4.091746 1.059036 -1.862569
H 1.675837 1.014832 -2.748421
H 1.729434 -0.755034 -2.794300
H 0.440377 0.069298 -1.908202
H -0.164563 -2.301290 2.244662
H -0.300032 2.181198 2.360832
H 3.751197 -2.331346 -0.820188
H 3.601900 2.606193 -0.692308
H 1.315342 -4.292968 2.128856
H 1.056594 4.261977 2.350391
H 3.251788 -4.309735 0.564972
H 2.986106 4.476496 0.792519


%chk=000214022-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214022

0 1
N -4.189389 -0.120535 -0.027001
C -3.377967 1.069360 -0.433527
C -3.307399 -1.235394 -0.494395
C -2.863466 0.752240 -1.885033
C -2.816939 -0.812070 -1.927067
C -2.198634 1.207221 0.566723
C -2.118452 -1.353552 0.496641
C -1.328776 -0.049296 0.614018
C 0.050258 -0.008566 0.697187
C -5.551350 -0.147284 -0.609091
C 2.411811 0.103927 -0.924685
C 0.931571 -1.218800 0.684463
C 0.856970 1.251724 0.747931
C 2.131164 -1.171079 -0.094072
C 2.056209 1.314892 -0.029636
C 3.870241 0.160946 -1.436953
C 1.472908 0.108747 -2.182238
C 0.671905 -2.359187 1.488375
C 0.530476 2.332432 1.607983
C 3.003662 -2.283972 -0.077335
C 2.862070 2.474486 0.046486
C 1.551756 -3.462220 1.496690
C 1.344418 3.483267 1.675029
C 2.718456 -3.428422 0.702597
C 2.510924 3.558561 0.883571
H -3.998676 1.981958 -0.391179
H -3.870752 -2.185428 -0.500068
H -1.873266 1.205329 -2.068210
H -3.558066 1.153069 -2.644853
H -3.488535 -1.212130 -2.707642
H -1.802247 -1.195670 -2.133020
H -2.642514 1.390110 1.566881
H -1.597506 2.094562 0.303102
H -1.463280 -2.184405 0.182528
H -2.545451 -1.620712 1.485111
H -6.123483 0.718122 -0.229381
H -6.068102 -1.065452 -0.276842
H -5.585342 -0.118622 -1.725063
H 4.603018 0.163427 -0.610017
H 4.084427 -0.702374 -2.091253
H 4.030741 1.065746 -2.049206
H 1.642857 1.025425 -2.776353
H 1.688381 -0.769898 -2.817539
H 0.409471 0.075384 -1.892136
H -0.206924 -2.364696 2.140814
H -0.347346 2.252420 2.256900
H 3.925976 -2.266770 -0.665531
H 3.783689 2.540456 -0.539145
H 1.335734 -4.330836 2.128654
H 1.077904 4.304100 2.350134
H 3.412716 -4.276317 0.702590
H 3.154450 4.444375 0.929662


