%chk=000203266.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203266

0 1
O -1.319936 1.104536 -0.854732
O 3.234359 1.916650 -1.181940
O 5.863780 -0.823700 0.674762
O 5.671855 1.074951 -0.541584
N -5.336826 -0.121817 -0.136216
N -0.495237 -0.702986 0.320670
C -4.013317 0.483632 -0.480028
C -6.335871 0.912041 0.292401
C -5.859840 -0.961545 -1.266091
C -2.920321 -0.464939 0.055130
C -5.976559 1.449455 1.678073
C -6.895721 -1.956090 -0.740165
C -1.547091 0.094051 -0.228707
C 0.896839 -0.445963 0.219352
C 1.411813 0.656143 -0.459168
C 1.769913 -1.383566 0.853731
C 2.807327 0.831115 -0.509980
C 3.693359 -0.088799 0.113326
C 3.135539 -1.195196 0.793150
C 5.124653 0.137560 0.031178
C 7.308988 -0.655595 0.630051
H -3.894496 1.481492 -0.000512
H -3.866218 0.655871 -1.568313
H -6.426071 1.749271 -0.433176
H -7.335875 0.423240 0.340009
H -6.296552 -0.352325 -2.087238
H -5.008756 -1.524610 -1.709660
H -3.040906 -1.471233 -0.398048
H -3.084037 -0.617520 1.144647
H -6.774142 2.089912 2.068848
H -5.051915 2.037967 1.665856
H -5.825186 0.627343 2.390254
H -7.169435 -2.683518 -1.511078
H -7.813424 -1.456396 -0.408799
H -6.505605 -2.508795 0.125174
H -0.753424 -1.543849 0.845583
H 0.765051 1.391737 -0.954187
H 1.363168 -2.240410 1.381721
H 3.816711 -1.905119 1.274436
H 4.265542 2.006787 -1.194463
H 7.582681 0.293188 1.102768
H 7.648513 -0.681367 -0.410394
H 7.662170 -1.519704 1.201960


%chk=000203266-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203266

0 1
O -1.384702 1.542415 0.402393
O 3.362029 2.326526 0.171013
O 5.915473 -1.069809 0.047294
O 5.719420 1.248120 0.056836
N -5.356885 -0.099244 -0.132580
N -0.502723 -0.634701 0.360752
C -3.981081 0.413909 -0.344463
C -6.395285 0.954737 -0.308356
C -5.637425 -1.323001 -0.933667
C -2.947166 -0.344272 0.522046
C -6.466980 1.928803 0.882896
C -6.742837 -2.204810 -0.321797
C -1.556765 0.289685 0.419103
C 0.894016 -0.398775 0.296486
C 1.452822 0.897117 0.265675
C 1.739324 -1.555558 0.260755
C 2.858204 1.044515 0.198301
C 3.717542 -0.110190 0.159446
C 3.125053 -1.403738 0.192835
C 5.164093 0.094174 0.085858
C 7.385165 -0.886086 -0.029637
H -3.935560 1.476483 -0.053759
H -3.676651 0.366587 -1.419247
H -6.236320 1.526233 -1.257694
H -7.372993 0.449367 -0.408081
H -5.899577 -1.064868 -1.991623
H -4.704759 -1.916369 -0.983880
H -2.924370 -1.419316 0.257096
H -3.286506 -0.279202 1.573657
H -7.264108 2.678500 0.721463
H -5.518494 2.477163 1.026547
H -6.684014 1.375108 1.812935
H -6.894794 -3.114849 -0.932028
H -7.710527 -1.674387 -0.267963
H -6.464673 -2.505454 0.703342
H -0.778563 -1.619513 0.373424
H 0.818115 1.783025 0.291963
H 1.296534 -2.558363 0.287130
H 3.780996 -2.278125 0.164249
H 4.380500 2.267150 0.122661
H 7.747888 -0.342201 0.858270
H 7.651510 -0.318166 -0.936377
H 7.790573 -1.906721 -0.064671


