%chk=000083999.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083999

0 1
 P    4.576600      0.9688000      0.5986000    
 O    1.122500      -1.343500     -0.5522000    
 O    3.404800      0.2467000     -0.2490000    
 O   -4.735500      0.3421000       1.690500    
 O    5.931100      0.5388000     -0.1730000    
 O    4.627300      9.1399997E-02   1.956000    
 O    4.395900       2.444400      0.8041000    
 N   -1.179400      -1.473600     -0.4291000    
 N   -1.787900      0.7938000      -1.064800    
 N   -2.784300      -1.790300       1.107700    
 N   -3.686500       1.676000      0.1117000    
 N   -2.535200       2.934100      -1.515300    
 C   -1.918100     -0.3414000     -0.3734000    
 C  -3.7500001E-02  -1.750900      -1.264600    
 C   -2.890700     -0.5419000      0.5622000    
 C   -1.745300      -2.327800      0.4908000    
 C    2.306500      -1.606800      -1.292700    
 C    3.506700      -1.152500     -0.4849000    
 C   -3.853700      0.5009000      0.8551000    
 C   -2.717300       1.791600     -0.7778000    
 H  -1.3500000E-02  -2.827100      -1.468000    
 H  -0.1404000      -1.196600      -2.203200    
 H   -1.357100      -3.322000      0.6663000    
 H   -1.064300      0.9482000      -1.759200    
 H    2.383200      -2.679100      -1.503800    
 H    2.263800      -1.052400      -2.237400    
 H    4.429400      -1.368900      -1.031000    
 H    3.523800      -1.671800      0.4783000    
 H   -1.787200       3.011100      -2.195700    
 H   -3.146000       3.735500      -1.400600    
 H    6.786900      0.9135000      0.1260000    
 H    5.208100      0.3855000       2.689800    


%chk=000083999-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083999

0 1
P 2.994272 1.584716 -0.569202
O 0.976189 -2.626210 -0.398740
O 2.414057 -0.026908 -0.880876
O -4.166461 0.993931 1.421629
O 4.662282 1.260772 -0.404296
O 2.465809 1.971200 0.984501
O 2.464779 2.545065 -1.720368
N -1.197714 -1.815667 -0.885887
N -0.407149 0.479852 -0.323501
N -3.304750 -1.675690 0.007311
N -2.052877 1.843123 0.804563
N 0.094344 2.741468 0.305133
C -1.336339 -0.543094 -0.348789
C 0.003309 -2.384497 -1.473091
C -2.628683 -0.449760 0.195629
C -2.433804 -2.466276 -0.623931
C 2.396084 -2.453459 -0.759051
C 2.974705 -1.192470 -0.129238
C -3.063612 0.789651 0.858999
C -0.868868 1.660255 0.270398
H -0.279437 -3.338007 -1.957589
H 0.427697 -1.692135 -2.227438
H -2.608490 -3.496954 -0.925157
H 0.580854 0.317004 -0.601602
H 2.928600 -3.331346 -0.348963
H 2.541948 -2.430482 -1.856755
H 4.074975 -1.173560 -0.224434
H 2.684804 -1.110882 0.934102
H 0.441205 3.022146 -0.634209
H -0.339850 3.535096 0.798620
H 5.214055 1.994368 -0.035232
H 1.434767 2.344552 0.908866


