%chk=000237770.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237770

0 1
O -0.602164 0.843037 -1.794502
O -2.589625 -1.486982 -0.413930
O -4.440525 -0.853307 0.664706
O 3.393243 1.914797 0.476422
O 1.258067 2.252813 0.405946
N -3.500329 1.824453 0.964765
N 2.244559 1.534050 0.344356
C -1.282222 0.846824 0.511926
C -2.762697 0.873891 0.111855
C -0.394883 0.492995 -0.660007
C 0.779897 -0.399478 -0.318798
C 2.021174 0.084968 0.117855
C 0.606866 -1.778081 -0.488202
C -3.381605 -0.533147 0.180897
C 3.090521 -0.792926 0.361304
C 1.665289 -2.656580 -0.237042
C 2.906424 -2.164533 0.183526
H -1.102779 0.192205 1.384860
H -0.974057 1.875556 0.854149
H -2.846093 1.224387 -0.965079
H -0.363532 -2.159220 -0.823860
H -3.484376 1.553650 1.944342
H -4.475263 1.902615 0.681073
H 4.058468 -0.392691 0.684886
H 1.523742 -3.730454 -0.374890
H 3.733176 -2.851805 0.370497
H -3.019974 -2.386434 -0.416755


%chk=000237770-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237770

0 1
O -0.670159 0.725688 -1.720468
O -2.732836 -1.486364 -0.449885
O -4.746303 -0.681037 0.369371
O 3.499340 1.981084 0.440813
O 1.253855 2.289681 0.212682
N -3.539717 1.854116 1.020129
N 2.304860 1.536087 0.256326
C -1.351683 0.727399 0.629693
C -2.825240 0.893979 0.176670
C -0.407927 0.412129 -0.532045
C 0.828201 -0.430746 -0.233612
C 2.110362 0.075017 0.091992
C 0.694715 -1.835052 -0.367918
C -3.554568 -0.464394 0.066336
C 3.232754 -0.763236 0.276910
C 1.803153 -2.689412 -0.178988
C 3.074355 -2.154993 0.142121
H -1.235627 -0.024597 1.430771
H -1.037076 1.704856 1.041022
H -2.781968 1.297838 -0.856330
H -0.287766 -2.241442 -0.626642
H -3.675623 1.536472 1.986150
H -4.422390 2.180322 0.614636
H 4.197560 -0.309995 0.519490
H 1.676282 -3.771739 -0.287846
H 3.933519 -2.817654 0.284526
H -3.278771 -2.313402 -0.555600


