%chk=000196855.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196855

0 1
N 1.831890 -1.393831 0.270900
N 7.973505 -0.157111 0.286735
N -2.444282 -0.812213 -0.298851
N 11.432205 2.354857 -1.043037
N -2.699885 0.863284 -2.058713
N -8.581024 0.965017 0.489291
N -9.481761 0.122901 0.709384
N -10.430723 -0.453610 0.946596
C 4.163966 -0.590088 0.400248
C 5.644382 -0.979947 0.338154
C 3.262893 -1.830660 0.284955
C 6.544545 0.263070 0.430923
C 0.900023 -2.562547 0.193151
C 8.905570 1.006421 0.414624
C -0.546187 -2.121546 0.456615
C 10.354572 0.501821 0.344556
C -1.027682 -1.095897 -0.585059
C 11.365855 1.658967 0.267964
C -3.150547 0.027007 -0.988882
C -4.576396 0.244036 -0.603008
C -5.430040 -0.856296 -0.449235
C -5.053730 1.545250 -0.367883
C -6.766507 -0.667013 -0.089302
C -6.381279 1.752206 -0.005985
C -7.237110 0.639045 0.128559
H 3.917569 0.117709 -0.418211
H 3.949979 -0.046451 1.340128
H 5.861207 -1.518159 -0.607985
H 5.887065 -1.691757 1.149867
H 3.493272 -2.550131 1.100170
H 3.468270 -2.357917 -0.673476
H 6.308747 0.961444 -0.403255
H 6.343358 0.814160 1.374855
H 1.166378 -3.379796 0.899572
H 0.989745 -2.990040 -0.830878
H 1.628500 -0.847705 1.115874
H 8.199372 -0.860761 0.998285
H 8.750679 1.593813 1.345719
H 8.699078 1.696487 -0.433655
H -0.653037 -1.693442 1.473157
H -1.212644 -3.007509 0.445183
H 10.471138 -0.171252 -0.529635
H 10.581676 -0.126781 1.226641
H -0.885291 -1.502612 -1.610647
H -0.400927 -0.175460 -0.519769
H 12.385688 1.274833 0.498203
H 11.145103 2.420183 1.049149
H 10.528483 2.749980 -1.286251
H 11.671776 1.701383 -1.783467
H -5.044496 -1.867595 -0.600319
H -4.375470 2.397169 -0.460520
H -1.858832 0.575937 -2.538599
H -3.404522 1.196346 -2.701289
H -7.416088 -1.530530 0.023866
H -6.761829 2.757631 0.179383


%chk=000196855-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196855

0 1
N 1.796038 -1.737469 0.366674
N 7.907587 -0.110288 0.206901
N -2.450684 -0.959548 -0.236658
N 11.143443 2.971620 -0.486937
N -2.524658 0.478137 -2.166092
N -8.488558 1.374940 0.325105
N -9.227295 0.711623 1.109931
N -10.068890 0.241457 1.803556
C 4.100395 -0.793623 0.400578
C 5.602467 -1.053418 0.153787
C 3.224040 -2.028481 0.114892
C 6.478528 0.178028 0.455047
C 0.875657 -2.874783 0.132692
C 8.825767 1.020876 0.455593
C -0.590225 -2.464934 0.372925
C 10.286042 0.629471 0.158814
C -1.074186 -1.365163 -0.589497
C 11.292412 1.792476 0.389683
C -3.077065 -0.104712 -1.019289
C -4.478172 0.291886 -0.675190
C -5.217329 -0.523096 0.223305
C -5.099775 1.456547 -1.200007
C -6.537507 -0.202650 0.578773
C -6.422779 1.791525 -0.853469
C -7.148068 0.960212 0.032925
H 3.747906 0.042844 -0.234063
H 3.949732 -0.476338 1.454998
H 5.771392 -1.355754 -0.898002
H 5.937928 -1.903900 0.785747
H 3.601908 -2.894603 0.718767
H 3.331281 -2.318490 -0.949933
H 6.178945 1.013302 -0.209886
H 6.280827 0.521839 1.504174
H 1.118676 -3.761917 0.770868
H 1.005117 -3.202272 -0.919682
H 1.659882 -1.347131 1.311699
H 8.210717 -0.953412 0.716638
H 8.759410 1.414396 1.504743
H 8.522849 1.852823 -0.213280
H -0.720063 -2.101007 1.411846
H -1.245530 -3.350600 0.270584
H 10.353803 0.272590 -0.887778
H 10.574579 -0.224502 0.809875
H -1.012876 -1.749357 -1.638315
H -0.363036 -0.511175 -0.524819
H 12.321562 1.405210 0.264301
H 11.216180 2.140056 1.439018
H 10.292423 3.518607 -0.327547
H 11.290347 2.775796 -1.482187
H -4.714735 -1.404140 0.633761
H -4.546486 2.140139 -1.854024
H -1.555454 0.293992 -2.411784
H -3.093166 0.999706 -2.827239
H -7.092500 -0.846694 1.271056
H -6.902602 2.691657 -1.248778


