%chk=000244047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244047

0 1
N 3.754563 0.091160 -0.214524
N 0.028879 -0.007921 -0.020852
N -1.010837 -1.106344 1.896102
C 2.343572 0.401372 -0.612419
C 4.678120 1.238362 -0.501861
C 4.231636 -1.172733 -0.870737
C 1.408739 -0.334726 0.374782
C 4.439918 2.366421 0.503576
C 5.426730 -1.741826 -0.103831
C -2.366435 0.045914 0.214656
C -1.001590 -0.328789 0.693556
C -3.116887 -0.843445 -0.580463
C -2.884869 1.299780 0.562386
C -4.401420 -0.458643 -0.998351
C -2.552130 -2.165707 -0.977006
C -4.163090 1.669966 0.138400
C -4.919549 0.787323 -0.639745
H 2.099640 0.116027 -1.657231
H 2.152851 1.494985 -0.545050
H 5.725435 0.874607 -0.398140
H 4.576565 1.622407 -1.539834
H 3.400449 -1.913016 -0.848664
H 4.496262 -1.029183 -1.940584
H 1.587799 -1.432520 0.329622
H 1.652030 -0.018876 1.413610
H 3.451160 2.823502 0.378619
H 4.487340 1.987036 1.533036
H 5.191835 3.153989 0.396970
H 6.314248 -1.105865 -0.197507
H 5.201652 -1.816723 0.968711
H 5.687343 -2.740882 -0.466128
H -2.284301 1.989818 1.154131
H -4.994386 -1.134482 -1.611432
H -1.659032 -2.029396 -1.610076
H -2.224410 -2.743366 -0.098204
H -3.259717 -2.787864 -1.536380
H -4.565481 2.643786 0.407506
H -5.916415 1.074721 -0.971743
H -0.173075 -1.083845 2.460068
H -1.846441 -1.047822 2.461533


%chk=000244047-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244047

0 1
N 3.745068 -0.035739 -0.240782
N -0.039328 0.034685 -0.023436
N -0.889060 -0.551216 2.152674
C 2.334132 0.157119 -0.662275
C 4.685361 0.923907 -0.877347
C 4.185903 -1.451504 -0.360226
C 1.342093 -0.135428 0.480323
C 4.593201 2.337519 -0.271149
C 5.326572 -1.814824 0.610227
C -2.459537 0.002807 0.359583
C -1.036554 -0.181333 0.806706
C -2.922592 -0.445526 -0.917687
C -3.362461 0.656383 1.242542
C -4.283877 -0.221039 -1.249491
C -2.026675 -1.151574 -1.918612
C -4.710049 0.876048 0.888558
C -5.174637 0.430718 -0.368085
H 2.062891 -0.474793 -1.541617
H 2.183185 1.204565 -0.976916
H 5.712656 0.544492 -0.725765
H 4.528606 0.976748 -1.985047
H 3.314195 -2.094216 -0.134439
H 4.490422 -1.696869 -1.410151
H 1.512961 -1.169046 0.867749
H 1.574674 0.559551 1.319663
H 3.583463 2.769714 -0.393392
H 4.818318 2.301236 0.809085
H 5.312223 3.019500 -0.763060
H 6.234994 -1.214430 0.421697
H 5.010915 -1.631707 1.652277
H 5.602548 -2.880866 0.502911
H -2.990466 1.033550 2.202510
H -4.648634 -0.569434 -2.223285
H -1.267643 -0.457552 -2.317447
H -1.460313 -1.975700 -1.448992
H -2.623971 -1.560671 -2.752508
H -5.383400 1.394509 1.579919
H -6.218507 0.589425 -0.661476
H 0.035545 -0.628158 2.569284
H -1.695517 -0.833647 2.703977


