%chk=000095711.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095711

0 1
 P  -1.6799999E-02  9.9999998E-03  0.1965000    
 O  -6.0800001E-02 -2.9899999E-02   1.708000    
 N    1.007400      -1.119400     -0.4802000    
 N   0.4968000       1.474300     -0.4203000    
 N   -1.492000     -0.2721000     -0.5299000    
 C   0.8387000      -2.526100     -0.1511000    
 C    1.861000       1.912100     -0.1590000    
 C   -2.634300      0.5512000     -0.1639000    
 H    2.000500     -0.9005000     -0.4037000    
 H   0.2984000       1.622300      -1.409700    
 H   -1.795600      -1.245600     -0.5297000    
 H    1.027300      -2.699300      0.9123000    
 H    1.543200      -3.130700     -0.7299000    
 H  -0.1706000      -2.870400     -0.3914000    
 H    2.584600       1.304100     -0.7088000    
 H    2.087300       1.855200      0.9096000    
 H    1.981200       2.953200     -0.4725000    
 H   -2.908300      0.3886000      0.8823000    
 H   -3.493700      0.2970000     -0.7911000    
 H   -2.414400       1.612300     -0.3106000    


%chk=000095711-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095711

0 1
P 0.275506 0.017012 0.120005
O 0.209004 0.505364 1.646871
N 1.006481 -1.476554 -0.405657
N 1.281721 1.102311 -0.800175
N -1.336060 -0.226390 -0.483250
C 0.472541 -2.800297 -0.031564
C 1.641331 2.440796 -0.306836
C -2.519698 0.360498 0.161215
H 2.024861 -1.419457 -0.497311
H 1.429490 0.899246 -1.790371
H -1.447172 -0.663661 -1.399395
H 0.879402 -3.175802 0.928581
H 0.697756 -3.535277 -0.825782
H -0.623825 -2.728287 0.068053
H 2.721997 2.630640 -0.448669
H 1.426970 2.472143 0.775694
H 1.069936 3.251901 -0.801999
H -3.310584 -0.401333 0.298429
H -2.941393 1.211335 -0.410742
H -2.218365 0.722111 1.159803


