%chk=000180555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180555

0 1
N 2.265198 1.614532 0.010605
N -2.265148 -1.614558 -0.011351
C 1.027041 0.918835 0.003778
C -1.026989 -0.918862 -0.004632
C 1.305641 -0.502647 0.009568
C -1.305589 0.502623 -0.010444
C 2.749639 -0.648745 0.019383
C -2.749588 0.648720 -0.020287
C -0.270983 1.433581 -0.006285
C 0.271032 -1.433607 0.005411
C 3.315268 0.676742 0.019322
C -3.315218 -0.676769 -0.020219
C 2.399200 3.074190 0.004996
C -2.399144 -3.074218 -0.006093
C 3.596327 -1.758164 0.028012
C -3.596275 1.758137 -0.028949
C 4.704770 0.877432 0.027625
C -4.704718 -0.877459 -0.028574
C 4.975368 -1.553983 0.036302
C -4.975318 1.553956 -0.037279
C 5.516274 -0.253085 0.036055
C -5.516223 0.253061 -0.037041
H -0.470829 2.498819 -0.010686
H 0.470883 -2.498845 0.009798
H 1.934039 3.506014 -0.900400
H 3.461310 3.372630 0.018296
H 1.909422 3.514703 0.893050
H -1.932801 -3.506329 0.898558
H -3.461271 -3.372653 -0.018070
H -1.910525 -3.514448 -0.894926
H 3.179562 -2.763058 0.028205
H -3.179513 2.763032 -0.029136
H 5.129372 1.874575 0.027475
H -5.129323 -1.874600 -0.028437
H 5.648359 -2.407598 0.043067
H -5.648305 2.407573 -0.044071
H 6.599701 -0.132852 0.042639
H -6.599649 0.132823 -0.043663


%chk=000180555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180555

0 1
N 2.279271 1.611626 0.010458
N -2.279221 -1.611652 -0.011224
C 1.048484 0.917203 0.003908
C -1.048433 -0.917229 -0.004743
C 1.321286 -0.503636 0.009608
C -1.321234 0.503611 -0.010469
C 2.770849 -0.651292 0.019480
C -2.770798 0.651266 -0.020380
C -0.260049 1.438358 -0.006165
C 0.260099 -1.438385 0.005312
C 3.331109 0.677217 0.019399
C -3.331058 -0.677243 -0.020290
C 2.399348 3.066305 0.004915
C -2.399292 -3.066332 -0.006018
C 3.632883 -1.773154 0.028288
C -3.632832 1.773127 -0.029226
C 4.729351 0.885936 0.027739
C -4.729299 -0.885963 -0.028696
C 5.030277 -1.570045 0.036763
C -5.030226 1.570019 -0.037747
C 5.567490 -0.251788 0.036421
C -5.567438 0.251763 -0.037419
H -0.453431 2.515507 -0.010606
H 0.453484 -2.515533 0.009720
H 1.937411 3.501430 -0.902251
H 3.462827 3.348465 0.018639
H 1.912471 3.509418 0.894910
H -1.936157 -3.501684 0.900419
H -3.462789 -3.348486 -0.018366
H -1.913592 -3.509224 -0.896775
H 3.220840 -2.788808 0.028553
H -3.220790 2.788782 -0.029487
H 5.157546 1.893625 0.027419
H -5.157495 -1.893651 -0.028414
H 5.710858 -2.428452 0.043615
H -5.710804 2.428427 -0.044636
H 6.655578 -0.118775 0.042963
H -6.655526 0.118746 -0.044016


