%chk=000235298.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235298

0 1
O -0.164707 -2.090917 -0.891630
O -2.182713 3.436044 -0.868505
O 4.222944 -1.171252 0.212918
N -0.779754 0.873514 -0.197556
N 2.742580 0.580336 0.399815
N 0.901033 2.277936 0.490031
N 2.021404 -1.631995 -0.337351
N -3.859752 -1.211894 0.059786
C 0.404772 0.119112 -0.168461
C -2.105179 0.347906 -0.573613
C 1.426233 1.016051 0.262523
C -0.445606 2.157140 0.206508
C -2.782181 -0.343221 0.632667
C 0.641068 -1.265501 -0.505970
C 3.078797 -0.774985 0.098188
C -1.408473 3.299290 0.325590
C 3.797740 1.520616 0.848961
C 2.424380 -3.032277 -0.647185
C -5.033016 -1.289961 0.978147
C -3.336188 -2.576838 -0.242219
H -2.741154 1.182765 -0.959191
H -1.980309 -0.382779 -1.414504
H -2.031996 -0.907076 1.229422
H -3.212483 0.422816 1.309947
H -2.175421 3.111338 1.107394
H -0.873013 4.245928 0.549459
H 4.772665 0.999432 0.907615
H 3.547402 1.926761 1.845281
H 3.884176 2.364278 0.141170
H 1.545344 -3.612249 -0.985772
H 2.850356 -3.516171 0.248721
H 3.189218 -3.044839 -1.443137
H -4.819342 -1.706955 1.972868
H -5.810561 -1.913454 0.505715
H -5.462457 -0.282859 1.101636
H -3.150976 -3.208028 0.638422
H -2.383809 -2.502271 -0.803571
H -4.060041 -3.089899 -0.894805
H -1.614081 3.741157 -1.612013


%chk=000235298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235298

0 1
O -0.084022 -2.187995 -0.904395
O -1.979183 3.590386 -1.069075
O 4.355290 -1.086548 0.243703
N -0.751080 0.791412 -0.225475
N 2.755349 0.623862 0.394878
N 0.882381 2.240546 0.461732
N 2.137603 -1.601971 -0.317542
N -3.955303 -1.192920 0.168618
C 0.448839 0.066394 -0.180271
C -2.082735 0.246098 -0.575339
C 1.425414 0.986024 0.241673
C -0.448311 2.086277 0.177038
C -2.754017 -0.469721 0.627450
C 0.742187 -1.306794 -0.505453
C 3.157787 -0.703667 0.118091
C -1.450588 3.198820 0.256123
C 3.754027 1.612935 0.844203
C 2.595226 -2.981662 -0.604108
C -5.064393 -1.209255 1.140530
C -3.655272 -2.538760 -0.367937
H -2.715010 1.071378 -0.937885
H -1.944722 -0.476456 -1.394491
H -2.007346 -1.145600 1.108948
H -3.051013 0.282637 1.382270
H -2.351461 2.898833 0.816509
H -0.969348 4.048117 0.774669
H 4.725294 1.101080 0.904339
H 3.470894 2.013341 1.831936
H 3.808032 2.449484 0.127428
H 1.717725 -3.556319 -0.934064
H 3.033874 -3.430029 0.302193
H 3.367479 -2.967779 -1.390265
H -4.844078 -1.803994 2.063107
H -5.960525 -1.648078 0.665300
H -5.315521 -0.177769 1.445499
H -3.400008 -3.273906 0.435421
H -2.794977 -2.496734 -1.056320
H -4.530773 -2.921644 -0.922645
H -1.230814 3.936975 -1.619093


