%chk=000186701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186701

0 1
N 0.537018 -0.311468 0.706009
N -0.540151 0.332822 0.694884
C 4.164699 0.453690 0.263111
C -4.167101 -0.446405 0.270815
C 5.352985 -0.191591 -0.248513
C -5.354562 0.182045 -0.263188
C 2.913547 -0.223757 0.215869
C -2.915859 0.229244 0.203846
C 4.256242 1.763531 0.810779
C -4.259534 -1.737953 0.860174
C 5.273104 -1.500478 -0.799664
C -5.273796 1.472559 -0.855980
C 6.606141 0.480586 -0.203066
C -6.607789 -0.488372 -0.198145
C 1.766893 0.441047 0.716962
C -1.770061 -0.419024 0.727992
C 2.867546 -1.560861 -0.350176
C -2.868937 1.547434 -0.404895
C 3.981822 -2.164010 -0.829866
C -3.982441 2.134802 -0.905489
C 5.550023 2.422901 0.845829
C -5.553353 -2.395952 0.914253
C 6.662286 1.816414 0.365820
C -6.664844 -1.805262 0.413206
C 3.097995 2.389286 1.303109
C -3.102092 -2.347467 1.374329
C 6.435830 -2.113048 -1.294659
C -6.435731 2.068886 -1.372179
C 1.869639 1.738774 1.253208
C -1.873662 -1.698826 1.305581
C 7.750855 -0.158861 -0.705592
C -7.751724 0.134598 -0.722693
C 7.660490 -1.443744 -1.245560
C -7.660496 1.401475 -1.303483
H 1.898173 -2.066508 -0.370760
H -1.899512 2.052156 -0.440256
H 3.941284 -3.168025 -1.252700
H -3.941219 3.124684 -1.360367
H 5.591606 3.425028 1.272818
H -5.595617 -3.383871 1.373097
H 7.633032 2.311926 0.391695
H -7.635612 -2.299777 0.453349
H 3.161597 3.392038 1.724995
H -3.166404 -3.336129 1.828158
H 6.381836 -3.114611 -1.718614
H -6.381071 3.056312 -1.828012
H 0.973232 2.234798 1.634082
H -0.977891 -2.182256 1.703729
H 8.713421 0.349070 -0.674334
H -8.714345 -0.372098 -0.676604
H 8.555923 -1.929537 -1.632861
H -8.555314 1.874584 -1.707546


%chk=000186701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186701

0 1
N 0.560619 -0.345334 0.015815
N -0.562924 0.348153 0.003920
C 4.228901 0.443160 0.006404
C -4.230536 -0.443490 0.012333
C 5.482856 -0.260065 0.010105
C -5.485187 0.258233 -0.007934
C 2.987008 -0.291693 0.012489
C -2.989359 0.292483 -0.002307
C 4.217795 1.885541 -0.003523
C -4.218002 -1.885473 0.047443
C 5.503400 -1.701702 0.019760
C -5.507177 1.699441 -0.043267
C 6.725943 0.473525 0.003889
C -6.727541 -0.476488 0.006774
C 1.744037 0.435397 0.007811
C -1.745705 -0.433251 0.017977
C 3.034732 -1.735663 0.022258
C -3.038557 1.736021 -0.037845
C 4.243834 -2.410661 0.025584
C -4.248322 2.409547 -0.057473
C 5.472488 2.596523 -0.009582
C -5.471985 -2.597596 0.061400
C 6.681343 1.917937 -0.006034
C -6.681499 -1.920465 0.042014
C 2.964244 2.568330 -0.007296
C -2.963810 -2.566820 0.066987
C 6.754212 -2.377868 0.023229
C -6.758656 2.374104 -0.062640
C 1.758022 1.863245 -0.001641
C -1.758273 -1.860692 0.052892
C 7.955074 -0.242756 0.007705
C -7.957383 0.238303 -0.013472
C 7.965511 -1.653368 0.017258
C -7.969231 1.648516 -0.047892
H 2.083468 -2.273010 0.026803
H -2.087843 2.274226 -0.048463
H 4.262920 -3.506941 0.032855
H -4.268508 3.505506 -0.084164
H 5.452137 3.692465 -0.017267
H -5.450550 -3.693232 0.087628
H 7.628008 2.470894 -0.010790
H -7.627615 -2.474274 0.052988
H 2.960129 3.664705 -0.015273
H -2.958655 -3.662913 0.092923
H 6.768941 -3.473993 0.030523
H -6.774469 3.469914 -0.089232
H 0.795893 2.382864 -0.005030
H -0.795621 -2.379187 0.067368
H 8.898924 0.314832 0.003191
H -8.900679 -0.320123 -0.001906
H 8.920238 -2.190129 0.020208
H -8.924490 2.184124 -0.063010


