%chk=000238992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238992

0 1
N 0.661650 -2.100359 -0.119761
N -3.034392 0.693603 -1.304978
N -1.236574 -0.704207 -0.559097
N -1.200585 1.694040 -0.120138
C 0.010793 -3.092895 -1.040942
C 0.915089 -2.692313 1.237869
C 0.944147 -4.302132 -1.210839
C 1.865702 -3.891448 1.093395
C 1.281296 -4.942971 0.141327
C -3.849280 1.916781 -1.031982
C -3.884377 -0.522449 -1.482454
C -4.770694 1.731621 0.184697
C -4.805783 -0.758827 -0.274139
C -5.652164 0.485024 0.029286
C 0.041382 -0.808115 -0.078427
C -1.815815 0.551457 -0.617248
C 0.757437 0.335259 0.372172
C 2.186750 0.272915 0.820133
C 0.062283 1.557558 0.344365
C 2.969490 1.516606 0.482248
C 3.479267 2.334745 1.500501
C 3.206654 1.852292 -0.860674
C 4.221829 3.474914 1.177404
C 3.946985 2.992541 -1.177677
C 4.457483 3.806186 -0.159660
H -0.157197 -2.597268 -2.023081
H -0.986609 -3.414440 -0.670819
H -0.035295 -3.013210 1.719958
H 1.367432 -1.923700 1.899057
H 1.878210 -3.979905 -1.713641
H 0.468917 -5.041085 -1.881602
H 2.058750 -4.333100 2.088028
H 2.845438 -3.543743 0.708309
H 0.374004 -5.395762 0.584431
H 2.000939 -5.770730 0.001215
H -4.444031 2.116381 -1.950610
H -3.178578 2.795026 -0.885435
H -3.240384 -1.412672 -1.664189
H -4.481910 -0.362764 -2.407315
H -5.397747 2.632025 0.318076
H -4.155925 1.650153 1.103448
H -4.192953 -1.024718 0.610178
H -5.458121 -1.629839 -0.466541
H -6.241285 0.323545 0.951436
H -6.389339 0.644808 -0.780924
H 2.692673 -0.600616 0.340325
H 2.220442 0.071975 1.912756
H 0.537174 2.482237 0.705779
H 3.299033 2.086676 2.543958
H 2.804496 1.221457 -1.652649
H 4.616121 4.106232 1.971686
H 4.126730 3.249787 -2.220237
H 5.034442 4.693522 -0.409176


%chk=000238992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238992

0 1
N 0.560534 -2.171129 0.112786
N -3.123901 0.644197 -0.756367
N -1.266427 -0.732856 -0.287429
N -1.234580 1.644556 0.256551
C -0.136712 -3.193329 -0.707132
C 1.223688 -2.754861 1.308076
C 0.864584 -4.272105 -1.171322
C 2.257508 -3.825668 0.901936
C 1.595775 -4.916864 0.028526
C -3.837079 1.936985 -0.754236
C -3.875297 -0.500755 -1.303672
C -5.189444 1.814558 -0.013074
C -5.228405 -0.667198 -0.571603
C -6.035029 0.653805 -0.590844
C 0.016180 -0.872643 0.164594
C -1.839466 0.513762 -0.255355
C 0.777512 0.266193 0.608320
C 2.274953 0.224316 0.907611
C 0.058259 1.482159 0.651515
C 3.045595 1.473103 0.481255
C 3.783458 2.230138 1.424627
C 3.062694 1.884222 -0.877893
C 4.523962 3.367883 1.025477
C 3.801396 3.016770 -1.281652
C 4.536594 3.764488 -0.330404
H -0.606985 -2.686254 -1.563564
H -0.958435 -3.664519 -0.120194
H 0.446171 -3.226573 1.955643
H 1.695316 -1.959804 1.902778
H 1.605477 -3.804150 -1.848635
H 0.321145 -5.041183 -1.753498
H 2.699225 -4.271047 1.814199
H 3.076867 -3.340188 0.336067
H 0.864082 -5.482211 0.642830
H 2.352248 -5.644227 -0.321338
H -4.023060 2.244627 -1.806899
H -3.177420 2.682039 -0.284809
H -3.244888 -1.396869 -1.201659
H -4.063188 -0.324593 -2.385859
H -5.736570 2.773567 -0.096121
H -4.995034 1.635485 1.062497
H -5.034028 -0.969008 0.476260
H -5.804002 -1.482499 -1.051493
H -6.977573 0.540262 -0.022331
H -6.317248 0.893860 -1.637772
H 2.697144 -0.653432 0.377302
H 2.461355 0.055029 1.988341
H 0.561988 2.394994 0.990928
H 3.777825 1.928053 2.479679
H 2.486844 1.313774 -1.616718
H 5.086569 3.941868 1.770681
H 3.804906 3.318262 -2.335485
H 5.108916 4.645109 -0.643316


