%chk=000077505.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077505

0 1
 P  -1.2700000E-02  -2.929900     -5.4699998E-02
 O    1.168300      -1.969900     -0.6013000    
 O   -1.118200      -1.921500      0.5650000    
 O   0.6199000      -3.631700       1.259600    
 O  -0.5499000      -3.899100      -1.068500    
 C    3.521300      0.7911000      0.3769000    
 C   -3.585800      0.7346000     -0.4083000    
 C    4.588800       1.603700     -0.3614000    
 C   -4.560500       1.629300      0.3625000    
 C    2.833300     -0.2506000     -0.5041000    
 C   -2.790400     -0.2121000      0.4891000    
 C    5.294500       2.629300      0.5267000    
 C   -5.374100       2.559500     -0.5381000    
 C    1.759100      -1.009600      0.2636000    
 C   -1.812900      -1.056900     -0.3174000    
 C    6.291700       3.458000     -0.2688000    
 C   -6.272300       3.475900      0.2790000    
 H    2.767600       1.478100      0.7814000    
 H    3.984200      0.2885000       1.235300    
 H   -2.890400       1.368800     -0.9722000    
 H   -4.146400      0.1466000      -1.145700    
 H    4.118600       2.119500      -1.208000    
 H    5.334500      0.9185000     -0.7835000    
 H   -5.245800      0.9988000      0.9427000    
 H   -3.994100       2.229000       1.086100    
 H    2.381600      0.2324000      -1.379400    
 H    3.571500     -0.9594000     -0.8990000    
 H   -3.471500     -0.8690000       1.044100    
 H   -2.238600      0.3582000       1.246600    
 H    4.554400       3.297500      0.9819000    
 H    5.815600       2.116800       1.343300    
 H   -5.987500       1.966600      -1.226100    
 H   -4.698400       3.169800      -1.148300    
 H   0.9892000     -0.3205000      0.6241000    
 H    2.198900      -1.524900       1.123500    
 H   -1.094600     -0.4184000     -0.8417000    
 H   -2.348200      -1.660900      -1.057500    
 H    7.061900       2.821500     -0.7161000    
 H    5.792100       4.009600      -1.071600    
 H    6.787300       4.183300      0.3842000    
 H   -6.979200       2.896600      0.8817000    
 H   -5.682300       4.106300      0.9519000    
 H   -6.847300       4.131000     -0.3829000    
 H   0.1325000      -4.369900       1.683400    


%chk=000077505-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077505

0 1
P -0.009350 -2.450015 -0.187243
O 1.433088 -1.665079 -0.656096
O -1.097650 -1.242271 0.425260
O 0.495310 -3.123817 1.317316
O -0.611928 -3.401132 -1.298354
C 4.158678 0.782549 0.433811
C -4.225119 0.764339 -0.490014
C 5.327863 1.440795 -0.333366
C -5.244076 1.545309 0.370495
C 3.316370 -0.159045 -0.460581
C -3.119109 0.094484 0.360562
C 6.165905 2.399592 0.542889
C -6.356742 2.217472 -0.465967
C 2.167931 -0.796393 0.319726
C -2.116608 -0.666484 -0.506852
C 7.334709 3.049499 -0.229016
C -7.369765 2.998106 0.399181
H 3.507368 1.575761 0.856873
H 4.562923 0.214907 1.297497
H -3.763138 1.455584 -1.225282
H -4.761416 -0.007418 -1.080225
H 4.927408 1.998240 -1.205556
H 5.988495 0.650346 -0.745937
H -5.706866 0.857329 1.108237
H -4.710283 2.320028 0.959598
H 2.902716 0.403361 -1.319174
H 3.956051 -0.960409 -0.875946
H -3.573599 -0.606762 1.086226
H -2.578730 0.862420 0.946834
H 5.504937 3.191187 0.951530
H 6.561882 1.843135 1.416854
H -6.890121 1.441878 -1.052749
H -5.893610 2.902356 -1.205313
H 1.470471 -0.035145 0.720419
H 2.529432 -1.431501 1.148391
H -1.605998 0.010477 -1.219153
H -2.597312 -1.487682 -1.071785
H 8.030867 2.281149 -0.614997
H 6.963143 3.629482 -1.094897
H 7.913540 3.736752 0.414987
H -7.865461 2.329978 1.128572
H -6.867799 3.802568 0.969277
H -8.157130 3.464236 -0.221086
H -0.231576 -3.515666 1.863051


