%chk=000210654.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210654

0 1
O -1.232623 -2.832101 -0.184706
N -4.294438 0.087136 0.096058
N 2.307272 0.023103 -0.005145
N 0.944951 0.038829 -0.051927
C -4.441336 1.008044 -1.079798
C -5.628747 -0.448597 0.528183
C 1.645922 -2.129950 -0.021145
C -5.349767 2.191890 -0.708084
C -6.555513 0.713554 0.923096
C -6.724881 1.703849 -0.235674
C 2.776370 -1.289571 0.013861
C 2.027733 -3.562260 0.011812
C 4.059716 -2.034021 0.084556
C 3.586789 -3.525273 0.098463
C -3.355821 -1.038933 -0.219773
C 0.517456 -1.272200 -0.063856
C -1.912482 -0.535045 -0.072550
C -0.915144 -1.662406 -0.116422
C 3.062990 1.250701 0.027646
C 4.387733 1.255885 -0.441300
C 2.468903 2.422844 0.528607
C 5.119744 2.444449 -0.391605
C 3.217383 3.600442 0.564438
C 4.540654 3.614324 0.110148
H -4.840342 0.493337 -1.980309
H -3.429424 1.385756 -1.342855
H -5.460252 -1.102646 1.411518
H -6.115026 -1.071460 -0.252848
H -5.454211 2.867912 -1.575227
H -4.868833 2.782924 0.097115
H -6.128319 1.238890 1.801014
H -7.535780 0.315860 1.240851
H -7.345518 2.561213 0.082836
H -7.267246 1.223753 -1.071693
H 1.579614 -4.087835 0.875613
H 1.677661 -4.100887 -0.888733
H 4.713572 -1.832362 -0.782672
H 4.637550 -1.786253 0.993334
H 3.929176 -4.023707 1.018981
H 4.029839 -4.073548 -0.747419
H -3.505673 -1.474626 -1.230714
H -3.519575 -1.873118 0.500792
H -1.670583 0.222245 -0.848221
H -1.804920 0.025790 0.885565
H 4.840434 0.353656 -0.849158
H 1.433252 2.410442 0.877844
H 6.148644 2.457422 -0.751478
H 2.764198 4.513969 0.950866
H 5.118399 4.536778 0.144712


%chk=000210654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210654

0 1
O -1.230316 -2.863298 -0.019681
N -4.357082 0.052777 0.150961
N 2.348790 -0.009314 -0.041603
N 0.951208 0.041691 -0.027717
C -4.348266 1.201201 -0.791677
C -5.719051 -0.532583 0.266533
C 1.677542 -2.153074 -0.001491
C -5.326835 2.304715 -0.339583
C -6.738510 0.514704 0.757834
C -6.757121 1.740812 -0.182778
C 2.799041 -1.329646 -0.019163
C 2.063123 -3.610533 -0.015693
C 4.103031 -2.089083 -0.038549
C 3.603724 -3.545042 0.307465
C -3.351742 -0.983751 -0.194873
C 0.545336 -1.278241 -0.010864
C -1.911139 -0.505137 0.051519
C -0.891380 -1.639462 -0.000667
C 3.090717 1.216394 -0.054392
C 4.483625 1.210122 -0.313226
C 2.414808 2.437689 0.187766
C 5.197416 2.427545 -0.315864
C 3.139882 3.646005 0.177684
C 4.533247 3.650313 -0.070098
H -4.624361 0.866737 -1.828987
H -3.324229 1.612672 -0.843219
H -5.670680 -1.378927 0.977154
H -6.066743 -0.945444 -0.719078
H -5.310682 3.133276 -1.074052
H -4.981167 2.709094 0.631600
H -6.453571 0.835738 1.778528
H -7.742265 0.051217 0.818043
H -7.441997 2.518989 0.204758
H -7.143240 1.435388 -1.177766
H 1.505068 -4.216108 0.717855
H 1.867808 -4.060128 -1.008303
H 4.577426 -2.053237 -1.040105
H 4.848167 -1.729893 0.694074
H 3.751032 -3.720208 1.388465
H 4.179699 -4.313611 -0.236167
H -3.454936 -1.331100 -1.254956
H -3.535760 -1.869068 0.439726
H -1.592080 0.282120 -0.656108
H -1.855691 -0.035015 1.055224
H 5.008692 0.275910 -0.525638
H 1.339332 2.416265 0.376693
H 6.274026 2.418092 -0.517932
H 2.614275 4.588195 0.367189
H 5.091331 4.592441 -0.074244


