%chk=000294857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294857

0 1
N -1.511112 -1.156709 -0.000439
N 1.511129 1.156738 -0.000447
N -1.482646 1.146582 0.000081
N 1.482657 -1.146553 0.000084
C -2.848502 -0.736499 -0.000322
C 2.848519 0.736523 -0.000320
C -0.726591 0.021100 -0.000202
C 0.726606 -0.021068 -0.000202
C -2.814366 0.702979 0.000072
C 2.814379 -0.702955 0.000059
C -5.240141 -0.709674 -0.000247
C 5.240158 0.709692 -0.000234
C -5.218969 0.731740 0.000185
C 5.218982 -0.731722 0.000162
C -4.065091 -1.444260 -0.000440
C 4.065108 1.444281 -0.000430
C -4.023894 1.429649 0.000350
C 4.023904 -1.429627 0.000330
C -6.551515 -1.427931 -0.000550
C 6.551535 1.427946 -0.000522
C -6.509978 1.487420 0.000490
C 6.509988 -1.487407 0.000439
H -1.159871 -2.100221 -0.000626
H 1.159892 2.100251 -0.000635
H -4.069625 -2.529865 -0.000743
H 4.069649 2.529886 -0.000732
H -3.987441 2.517867 0.000549
H 3.987452 -2.517846 0.000529
H -7.147872 -1.168277 -0.887346
H -6.438479 -2.519894 0.001056
H -7.149773 -1.165931 0.884255
H 7.149571 1.166285 0.884535
H 7.148114 1.167954 -0.887067
H 6.438497 2.519910 0.000627
H -6.360943 2.575550 -0.001864
H -7.115247 1.245794 -0.884669
H -7.112534 1.249170 0.888435
H 7.112772 -1.248845 0.888143
H 6.360946 -2.575537 -0.001481
H 7.115030 -1.246100 -0.884963


%chk=000294857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294857

0 1
N -1.497053 -1.135437 -0.000201
N 1.497069 1.135461 -0.000206
N -1.465730 1.155911 -0.000164
N 1.465743 -1.155887 -0.000162
C -2.838194 -0.736854 -0.000191
C 2.838210 0.736876 -0.000193
C -0.721686 0.026879 -0.000174
C 0.721700 -0.026854 -0.000175
C -2.799731 0.700423 -0.000138
C 2.799745 -0.700401 -0.000143
C -5.260007 -0.712090 -0.000127
C 5.260022 0.712109 -0.000137
C -5.238691 0.734943 -0.000114
C 5.238705 -0.734924 -0.000120
C -4.055128 -1.448590 -0.000168
C 4.055145 1.448611 -0.000176
C -4.012076 1.429655 -0.000124
C 4.012089 -1.429635 -0.000128
C -6.587915 -1.447502 -0.000178
C 6.587932 1.447520 -0.000164
C -6.545457 1.509581 0.000111
C 6.545470 -1.509564 0.000075
H -1.106631 -2.077727 -0.000185
H 1.106649 2.077751 -0.000192
H -4.077133 -2.544203 -0.000162
H 4.077151 2.544224 -0.000176
H -3.985586 2.524402 -0.000131
H 3.985598 -2.524382 -0.000130
H -7.197543 -1.191674 -0.888822
H -6.441473 -2.541621 0.001428
H -7.199024 -1.189209 0.886705
H 7.198859 1.189510 0.886930
H 7.197740 1.191406 -0.888598
H 6.441491 2.541639 0.001069
H -6.361604 2.597726 -0.001912
H -7.164905 1.272613 -0.887071
H -7.162719 1.275601 0.889642
H 7.162920 -1.275317 0.889402
H 6.361615 -2.597709 -0.001587
H 7.164730 -1.272864 -0.887312


