%chk=000232175.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232175

0 1
O 2.893615 -1.312453 -1.592616
N 0.466192 -0.230555 -0.358714
N -1.208414 -1.636965 -1.074539
N -0.955870 1.455692 0.847630
N -3.343392 0.916998 0.729159
N -4.177669 -1.004945 -0.392733
N -5.528882 -0.710095 -0.095956
C 1.813521 0.306944 -0.073744
C 2.773267 0.079441 -1.276661
C 2.384460 -0.309579 1.217940
C 4.149095 0.684801 -0.962571
C 3.757208 0.301128 1.522638
C 4.731186 0.140218 0.348026
C -0.732985 0.314002 0.109690
C 0.112611 -1.427040 -1.066293
C -1.769521 -0.572736 -0.350206
C -3.111307 -0.225899 -0.008665
C -2.266387 1.682607 1.109614
H 1.698452 1.420746 0.078583
H 2.339216 0.491344 -2.218259
H 2.453696 -1.409655 1.127163
H 1.688140 -0.121971 2.061175
H 4.071370 1.788410 -0.916886
H 4.840329 0.465168 -1.801367
H 4.181103 -0.170983 2.430253
H 3.642062 1.375304 1.771484
H 5.681967 0.660731 0.576054
H 4.999691 -0.927467 0.224157
H 0.875444 -2.039370 -1.544886
H 3.409327 -1.783923 -0.902520
H -2.511018 2.584115 1.697112
H -4.046023 -1.853209 -0.952268
H -5.772903 0.225585 -0.457592
H -5.656281 -0.646992 0.926599


%chk=000232175-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232175

0 1
O 2.966616 -1.330202 -1.651535
N 0.445522 -0.362806 -0.311091
N -1.267536 -1.743223 -0.981946
N -0.888820 1.432654 0.775818
N -3.307155 0.987743 0.657047
N -4.207385 -0.948944 -0.381935
N -5.551895 -0.582492 -0.115160
C 1.790779 0.186614 -0.034174
C 2.737695 0.079897 -1.257740
C 2.432097 -0.437895 1.230232
C 4.071895 0.794894 -0.946461
C 3.775952 0.265491 1.545672
C 4.742174 0.234164 0.335963
C -0.742186 0.249230 0.106882
C 0.068819 -1.557188 -0.952999
C -1.784836 -0.615499 -0.318534
C -3.114913 -0.196070 -0.014939
C -2.202461 1.722057 1.007459
H 1.620444 1.263676 0.166773
H 2.249536 0.521045 -2.143904
H 2.588477 -1.524144 1.072484
H 1.734468 -0.333209 2.080237
H 3.874382 1.876587 -0.811908
H 4.745038 0.691622 -1.817507
H 4.249910 -0.206677 2.426491
H 3.572596 1.320614 1.820260
H 5.655403 0.816652 0.558542
H 5.089635 -0.808658 0.166466
H 0.811140 -2.214349 -1.396663
H 3.671717 -1.714200 -1.071477
H -2.405963 2.656043 1.540108
H -4.063147 -1.824847 -0.885167
H -5.772127 0.317047 -0.567779
H -5.704571 -0.506229 0.901286


