%chk=000078438.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078438

0 1
 P  -2.0999999E-03  0.6077000     -0.6375000    
 O  -1.0300000E-02  0.7108000      -2.152100    
 N   -1.209800       1.437800      0.1560000    
 N    1.215200       1.433500      0.1437000    
 C  -1.5000000E-03  -1.107300     -9.0599999E-02
 C   -2.589400       1.148200      0.1105000    
 C    2.594600       1.139100      8.3999999E-02
 C   0.2054000      -1.377600       1.244700    
 C  -0.2084000      -2.100500      -1.023100    
 C   0.2057000      -2.706700       1.668400    
 C  -0.2082000      -3.429500     -0.5995000    
 C   -3.480500       1.873000      0.9017000    
 C    3.494800       1.860700      0.8668000    
 C   -3.062900      0.1377000     -0.7265000    
 C    3.054800      0.1269000     -0.7570000    
 C  -1.1000000E-03  -3.732600      0.7462000    
 C   -4.845100       1.587400      0.8562000    
 C    4.857700       1.569600      0.8085000    
 C   -4.427500     -0.1479000     -0.7720000    
 C    4.417700     -0.1644000     -0.8153000    
 C   -5.318500      0.5770000      1.9400001E-02
 C    5.319100      0.5570000     -3.2499999E-02
 H   -1.001700       2.232400      0.7559000    
 H    1.016600       2.229600      0.7450000    
 H   0.3612000     -0.5836000       1.967400    
 H  -0.3691000      -1.875600      -2.071800    
 H   0.3655000      -2.942500       2.716400    
 H  -0.3691000      -4.228400      -1.317500    
 H   -3.125800       2.663200       1.558700    
 H    3.149200       2.651900       1.527100    
 H   -2.412700     -0.4260000      -1.383400    
 H    2.390900     -0.4437000      -1.396600    
 H  -1.2000001E-03  -4.767300       1.076000    
 H   -5.539100       2.151900       1.472000    
 H    5.559600       2.131200       1.418000    
 H   -4.797600     -0.9292000      -1.429500    
 H    4.777900     -0.9498000      -1.473400    
 H   -6.381100      0.3559000     -1.7500000E-02
 H    6.380300      0.3310000     -7.8699999E-02


%chk=000078438-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078438

0 1
P -0.335246 -0.710571 -0.372078
O -0.343673 -0.940636 -1.957294
N -1.846504 -0.300441 0.425634
N 0.618174 0.656112 0.179596
C 0.188740 -2.235851 0.554211
C -2.719464 0.766812 0.074002
C 1.927940 1.015396 -0.232947
C 0.579968 -2.175429 1.911539
C 0.197684 -3.461281 -0.151881
C 0.966877 -3.361461 2.575090
C 0.589090 -4.642786 0.516755
C -3.865323 1.015769 0.877645
C 2.582824 2.087174 0.434140
C -2.464372 1.592944 -1.054755
C 2.600629 0.333665 -1.283369
C 0.968301 -4.593432 1.878954
C -4.736553 2.078922 0.559199
C 3.889159 2.464882 0.060045
C -3.339850 2.657780 -1.354189
C 3.911452 0.716523 -1.638129
C -4.478014 2.912060 -0.553952
C 4.567448 1.779059 -0.974288
H -2.209361 -0.993439 1.084134
H 0.134705 1.298728 0.811435
H 0.608505 -1.213188 2.435610
H -0.088043 -3.469714 -1.209782
H 1.275546 -3.324270 3.625276
H 0.601859 -5.595785 -0.022749
H -4.068689 0.380810 1.749362
H 2.068867 2.620085 1.244507
H -1.612140 1.381804 -1.709272
H 2.087872 -0.459218 -1.837930
H 1.273545 -5.510819 2.394558
H -5.617460 2.256945 1.186544
H 4.378198 3.295140 0.582531
H -3.134855 3.284269 -2.229552
H 4.417802 0.185000 -2.452059
H -5.154916 3.737547 -0.797148
H 5.582777 2.071796 -1.261296


