%chk=000238713.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238713

0 1
N -4.580659 0.194505 0.151216
N 5.347951 0.234304 0.325012
C -0.347124 0.097350 0.126528
C -1.068607 -1.114292 0.086357
C -2.474841 -1.086837 0.060751
C 1.132212 0.105035 0.154359
C -2.421758 1.371692 0.126439
C -3.153456 0.159643 0.080359
C -1.025839 1.319957 0.148552
C 1.884011 0.180912 -1.039045
C -0.302691 -2.400796 0.079540
C 1.795437 0.046589 1.387547
C -3.274665 -2.353291 0.029574
C -3.113115 2.698029 0.164544
C 3.281445 0.188472 -0.981533
C 3.935654 0.133296 0.266075
C 3.186980 0.054718 1.458437
C 1.191142 0.258331 -2.360981
H -0.450205 2.244832 0.187369
H 0.437469 -2.418141 -0.733266
H 0.254927 -2.523559 1.019909
H -0.946749 -3.284072 -0.038962
H 1.209247 -0.006025 2.306374
H -3.919356 -2.406982 -0.856622
H -2.634444 -3.250092 0.010722
H -3.909184 -2.437297 0.924726
H -2.403082 3.532544 0.240632
H -3.712297 2.872105 -0.738325
H -3.779134 2.771233 1.037700
H 3.860461 0.257467 -1.897044
H 3.683733 0.019911 2.422160
H 1.876239 0.173257 -3.211871
H 0.432787 -0.532693 -2.462485
H 0.656496 1.215773 -2.460681
H -5.041638 -0.608610 -0.257508
H -4.995426 1.046499 -0.204800
H 5.851296 -0.026815 -0.509663
H 5.787685 -0.120651 1.161104


%chk=000238713-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238713

0 1
N -4.589024 0.274526 0.110152
N 5.431118 0.307000 0.310139
C -0.338231 0.091819 0.122726
C -1.101720 -1.106329 -0.035706
C -2.524848 -1.042542 -0.045488
C 1.164491 0.111974 0.139751
C -2.432740 1.413083 0.299183
C -3.187327 0.213923 0.119178
C -1.027850 1.320098 0.296490
C 1.948987 -0.084476 -1.040944
C -0.397797 -2.452313 -0.153388
C 1.846742 0.391659 1.352821
C -3.386457 -2.283898 -0.218598
C -3.135623 2.745789 0.481729
C 3.359089 -0.015037 -0.963898
C 4.033724 0.248138 0.261559
C 3.251308 0.458954 1.430651
C 1.289035 -0.342329 -2.385533
H -0.436886 2.236063 0.420657
H 0.691614 -2.333935 -0.043234
H -0.735992 -3.155839 0.631043
H -0.590089 -2.939907 -1.129603
H 1.251801 0.550471 2.260127
H -4.048998 -2.196964 -1.105192
H -2.784126 -3.193548 -0.357027
H -4.038691 -2.456309 0.663312
H -2.403821 3.561000 0.608595
H -3.768643 3.006149 -0.392017
H -3.791468 2.751210 1.377219
H 3.949775 -0.157697 -1.879023
H 3.742173 0.671523 2.388683
H 2.006823 -0.214732 -3.214831
H 0.882444 -1.369691 -2.448194
H 0.438000 0.342844 -2.548438
H -5.148255 -0.563510 -0.004545
H -5.067790 1.159662 0.237860
H 5.987861 0.156813 -0.525343
H 5.912293 0.502656 1.182327


