%chk=000231247.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231247

0 1
N 1.586746 0.001497 0.241274
N -1.586733 -0.019869 0.232992
N 2.798966 0.629616 0.258561
N -2.799467 -0.647589 0.221881
C 0.622694 0.421382 -0.533370
C -0.618911 -0.412653 -0.551072
C 0.608341 1.617385 -1.413065
C -0.600194 -1.577194 -1.471928
C -0.270088 2.675648 -1.138981
C 0.278429 -2.643559 -1.231931
C 1.471809 1.684486 -2.516621
C -1.459778 -1.606575 -2.580163
C -0.273784 3.804015 -1.962914
C 0.286211 -3.742440 -2.094756
C 1.459639 2.814897 -3.338008
C -1.443542 -2.707587 -3.440491
C 3.701401 0.271426 1.313972
C -3.705812 -0.327207 1.286325
C 0.590503 3.875350 -3.060716
C -0.574196 -3.776220 -3.197400
C 4.821255 1.106558 1.510188
C -4.824623 -1.170500 1.450766
C 3.537965 -0.896647 2.082837
C -3.547170 0.814759 2.094380
C 5.772650 0.754651 2.468837
C -5.779891 -0.852622 2.417432
C 4.500377 -1.223408 3.037148
C -4.513328 1.107637 3.055896
C 5.618779 -0.405027 3.234227
C -5.630780 0.281072 3.221707
H -0.951282 2.607724 -0.287846
H 0.956534 -2.604830 -0.376498
H 2.140023 0.851926 -2.737522
H -2.128165 -0.767455 -2.774170
H -0.954619 4.627213 -1.751051
H 0.967199 -4.571882 -1.909401
H 2.126195 2.867502 -4.197407
H -2.107110 -2.730792 -4.303492
H 2.889178 1.583483 -0.119188
H -2.886699 -1.588850 -0.187219
H 0.583669 4.755120 -3.702047
H -0.564169 -4.633040 -3.869043
H 4.954039 2.011017 0.923422
H -4.953686 -2.055088 0.833646
H 2.666049 -1.533376 1.932386
H -2.675991 1.457755 1.968224
H 6.641678 1.394296 2.621134
H -6.648166 -1.498595 2.545323
H 4.377957 -2.126299 3.635307
H -4.394624 1.990218 3.684342
H 6.363333 -0.669882 3.980138
H -6.378310 0.519454 3.973558


%chk=000231247-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231247

0 1
N 1.784276 -0.131402 -0.053486
N -1.782144 0.122105 -0.052662
N 2.907024 0.648459 -0.005803
N -2.904784 -0.658521 -0.015098
C 0.578825 0.448728 -0.017199
C -0.576589 -0.458045 -0.021671
C 0.374955 1.936897 0.013705
C -0.372618 -1.946545 -0.007571
C -0.260720 2.567804 1.114877
C 0.260849 -2.590215 1.087425
C 0.846447 2.743250 -1.058313
C -0.842399 -2.740342 -1.089673
C -0.418426 3.970372 1.146359
C 0.418150 -3.993105 1.103036
C 0.683617 4.147114 -1.029384
C -0.679884 -4.144492 -1.076680
C 4.187634 0.059165 -0.023400
C -4.185542 -0.069435 -0.027812
C 0.053903 4.765453 0.075193
C -0.052350 -4.775647 0.021877
C 5.328246 0.903141 0.065700
C -5.326038 -0.914686 0.050000
C 4.354114 -1.348052 -0.133793
C -4.352290 1.338926 -0.122013
C 6.621548 0.341505 0.044657
C -6.619470 -0.353155 0.033960
C 5.654511 -1.891411 -0.152928
C -5.652809 1.882154 -0.136374
C 6.796463 -1.058468 -0.064520
C -6.794644 1.047944 -0.059076
H -0.640596 1.953607 1.937616
H 0.639251 -1.985652 1.917948
H 1.309804 2.265902 -1.930196
H -1.304334 -2.252774 -1.956643
H -0.914132 4.442270 2.002029
H 0.912126 -4.474970 1.954140
H 1.040368 4.753320 -1.869589
H -1.035160 -4.740880 -1.924504
H 2.830839 1.673013 0.067956
H -2.828421 -1.683847 0.046860
H -0.073031 5.853541 0.099032
H 0.074426 -5.863955 0.033350
H 5.201036 1.990077 0.151653
H -5.198680 -2.002514 0.123465
H 3.466225 -1.981537 -0.204696
H -3.464488 1.973430 -0.184439
H 7.494420 1.000606 0.114156
H -7.492249 -1.013247 0.094694
H 5.777578 -2.977240 -0.239463
H -5.776053 2.968888 -0.210366
H 7.802278 -1.491114 -0.081015
H -7.800560 1.480483 -0.071719


