%chk=000216542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216542

0 1
N -0.488035 -0.459369 0.371851
N 2.342142 -0.177185 -0.487582
N -2.518799 0.781972 0.384618
N -2.456687 -1.575883 -0.381703
N 4.431908 -0.909191 0.385291
N -5.924948 -0.148049 -0.239405
N -4.823870 1.740598 0.468858
C 0.293302 -1.583786 -0.232528
C 0.283459 0.797283 0.583901
C 1.786045 -1.442238 0.092079
C 1.379226 0.963461 -0.484030
C -1.853708 -0.389280 0.090746
C 3.702055 0.098042 -0.211330
C 4.314857 1.305308 -0.643869
C -3.870569 0.730031 0.240980
C -4.557281 -0.473314 -0.211848
C -3.788013 -1.610446 -0.519898
C 5.686531 1.455045 -0.469805
C 5.767885 -0.730488 0.530137
C 6.436847 0.432299 0.123438
C -6.022938 1.189996 0.179059
H 0.132328 -1.633215 -1.334390
H -0.098566 -2.540171 0.190762
H 0.726579 0.736068 1.605766
H -0.385995 1.692595 0.589577
H 1.959243 -1.499609 1.191890
H 2.351754 -2.293821 -0.358009
H 0.923595 0.998220 -1.502755
H 1.894777 1.937771 -0.335206
H 3.729822 2.085020 -1.120756
H -4.235133 -2.542899 -0.882796
H 6.179192 2.371120 -0.798244
H 6.305072 -1.562469 1.002331
H -6.661588 -0.772185 -0.502695
H 7.506836 0.535151 0.265086
H -6.972323 1.710320 0.254777


%chk=000216542-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216542

0 1
N -0.473446 -0.321265 0.641613
N 2.338742 0.047814 0.537074
N -2.543747 0.785724 0.361236
N -2.212183 -1.569488 -0.328541
N 4.350190 -1.056574 -0.022119
N -5.680558 -0.241066 -0.974887
N -4.813522 1.678408 -0.060857
C 0.402689 -1.509710 0.487998
C 0.115960 0.899280 1.219160
C 1.790170 -1.208830 1.083951
C 1.455289 1.232084 0.534250
C -1.785679 -0.355879 0.215192
C 3.607129 0.102638 -0.031345
C 4.121209 1.314910 -0.602143
C -3.819254 0.674800 -0.080891
C -4.346866 -0.537986 -0.654079
C -3.495168 -1.653372 -0.761065
C 5.412357 1.304933 -1.157125
C 5.594634 -1.032871 -0.569649
C 6.180792 0.113615 -1.148826
C -5.894477 1.088043 -0.599280
H 0.489859 -1.769950 -0.583742
H -0.050315 -2.383174 0.994018
H 0.268098 0.773401 2.310346
H -0.604363 1.719502 1.076038
H 1.727959 -1.154238 2.190125
H 2.500212 -2.011373 0.829852
H 1.262540 1.564501 -0.507571
H 1.930344 2.079510 1.072737
H 3.527823 2.232431 -0.611752
H -3.808121 -2.615403 -1.183784
H 5.818706 2.223275 -1.595963
H 6.139295 -1.984541 -0.536470
H -6.363834 -0.866252 -1.398722
H 7.188301 0.074295 -1.571742
H -6.855763 1.579508 -0.738740


