%chk=000206876.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206876

0 1
O 1.957942 1.302663 2.415752
O -5.266099 -0.298043 -0.957786
N 2.661695 -0.414280 1.107307
N 4.550033 -0.541435 -1.080205
N -0.742490 0.226374 2.145143
C 4.090254 -0.041556 1.314274
C 2.489579 -1.389015 0.002610
C 4.711552 0.484431 0.004248
C 3.096652 -0.842562 -1.306619
C 1.673752 0.449529 1.580460
C 5.182960 -0.062256 -2.344625
C 0.259620 0.239507 1.164300
C -1.733202 0.033322 0.086133
C -0.316850 0.125212 -0.099318
C -1.981904 0.102571 1.500434
C -2.818410 -0.104394 -0.809303
C -3.290983 0.035505 2.036711
C -4.083670 -0.164796 -0.257276
C -4.336195 -0.097208 1.155299
C -5.187017 -0.364849 -2.401217
H 4.633748 -0.947236 1.666251
H 4.165475 0.730366 2.116323
H 1.422172 -1.659516 -0.135322
H 3.020157 -2.326941 0.298644
H 4.268650 1.469999 -0.255699
H 5.800191 0.648720 0.159596
H 3.026615 -1.621931 -2.096120
H 2.517261 0.035734 -1.662375
H 5.100640 -0.852082 -3.108915
H 6.259286 0.097420 -2.167027
H 4.759513 0.865401 -2.756800
H 0.187944 0.125302 -1.043033
H -0.589287 0.375032 3.126434
H -2.631650 -0.154880 -1.874129
H -3.452252 0.090218 3.110485
H -5.370831 -0.152987 1.490822
H -4.620042 -1.247701 -2.709848
H -4.755641 0.557299 -2.801253
H -6.244468 -0.458239 -2.680357


%chk=000206876-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206876

0 1
O 1.777335 0.765956 2.706065
O -5.504500 -0.168410 -0.868905
N 2.655504 -0.372102 0.873747
N 4.746966 -0.427130 -1.089075
N -0.790856 0.218089 2.088496
C 4.038350 -0.025372 1.266015
C 2.608275 -1.333886 -0.243933
C 4.790178 0.534393 0.041354
C 3.351812 -0.758329 -1.465992
C 1.590248 0.139161 1.599478
C 5.552784 0.018627 -2.241950
C 0.190092 -0.012489 1.113816
C -1.876119 -0.123211 0.111480
C -0.456586 -0.220902 -0.121344
C -2.055245 0.157075 1.513995
C -3.014048 -0.241737 -0.738365
C -3.341825 0.318298 2.082421
C -4.287769 -0.078485 -0.162431
C -4.450539 0.199618 1.233612
C -5.423793 -0.451132 -2.300499
H 4.555761 -0.933851 1.633336
H 3.988984 0.712197 2.082403
H 1.570005 -1.595863 -0.485109
H 3.132207 -2.258748 0.073115
H 4.339974 1.521639 -0.237446
H 5.847790 0.709140 0.313237
H 3.375025 -1.513807 -2.273789
H 2.796213 0.138817 -1.846098
H 5.546425 -0.761965 -3.023763
H 6.599121 0.175218 -1.924418
H 5.183799 0.971114 -2.699665
H 0.018068 -0.372296 -1.088582
H -0.529456 0.496002 3.036211
H -2.885376 -0.454944 -1.803343
H -3.477454 0.530656 3.147889
H -5.469973 0.315788 1.613585
H -4.938827 -1.429199 -2.492167
H -4.871471 0.344675 -2.839098
H -6.466378 -0.479907 -2.650282


