%chk=000225703.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225703

0 1
O -0.000549 0.949990 -0.001640
N -1.181629 -1.051713 -0.027655
N 1.180090 -1.051652 0.037855
N -6.504959 0.854481 -0.185615
N 6.503173 0.856543 0.176880
C -2.512853 -0.512933 -0.037572
C 2.511248 -0.512532 0.042310
C -3.575015 -1.420933 0.145496
C 3.573111 -1.420255 -0.143539
C -2.778880 0.854101 -0.236995
C 2.777306 0.854777 0.239896
C -0.000717 -0.268627 0.002298
C -5.161040 0.403349 -0.071039
C 5.159085 0.404795 0.066799
C -4.890775 -0.965810 0.129395
C 4.888752 -0.964604 -0.131797
C -4.093173 1.308258 -0.250876
C 4.091448 1.309461 0.249273
H -1.120968 -2.067173 0.021518
H 1.119510 -2.067377 -0.005160
H -3.381188 -2.480398 0.300239
H 3.379193 -2.479873 -0.297088
H -1.954768 1.564503 -0.376751
H 1.953305 1.564907 0.381443
H -5.706724 -1.672750 0.259987
H 5.704560 -1.671325 -0.264448
H -4.292292 2.365791 -0.414028
H 4.290681 2.367202 0.410927
H -7.193530 0.287027 0.289177
H -6.648083 1.836874 0.005965
H 7.190481 0.288962 -0.299621
H 6.645302 1.838836 -0.016030


%chk=000225703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225703

0 1
O -0.001574 1.190428 -0.000916
N -1.166703 -0.862215 -0.005788
N 1.164952 -0.861609 0.007028
N -6.645136 0.684955 -0.011023
N 6.643229 0.686392 0.009892
C -2.522609 -0.414426 -0.007011
C 2.520775 -0.413439 0.007587
C -3.541181 -1.403804 -0.009845
C 3.539479 -1.402674 0.012039
C -2.903593 0.953785 -0.005655
C 2.901645 0.954822 0.004056
C -0.001097 -0.078291 0.000062
C -5.293155 0.320009 -0.009657
C 5.291284 0.321304 0.009119
C -4.902989 -1.049021 -0.011266
C 4.901252 -1.047754 0.012926
C -4.266551 1.306228 -0.006808
C 4.264572 1.307402 0.004678
H -1.058522 -1.878364 -0.012557
H 1.057182 -1.877788 0.015297
H -3.269413 -2.468565 -0.010775
H 3.267836 -2.467462 0.014696
H -2.127880 1.721343 -0.003943
H 2.125884 1.722305 0.001129
H -5.667324 -1.835698 -0.013473
H 5.665666 -1.834349 0.016424
H -4.539355 2.369035 -0.005786
H 4.537270 2.370232 0.001954
H -7.375913 -0.019547 -0.012255
H -6.918344 1.662617 -0.008443
H 7.374082 -0.018029 0.012250
H 6.916332 1.664078 0.005666


