%chk=000117798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117798

0 1
 P   0.1030000     -6.6399999E-02 -0.3585000    
 O    1.519000      0.3977000      0.2691000    
 O  -0.9639000      0.9120000      0.3716000    
 O  -0.1631000      -1.490800      0.3591000    
 O   3.7599999E-02 -7.9800002E-02  -1.860100    
 C    2.107800       1.615600      6.2199999E-02
 C    3.332700       1.918300      0.6499000    
 C   -2.317300      0.8176000      0.2633000    
 C   -5.091400      0.6229000      4.1099999E-02
 C    1.463800       2.548800     -0.7455000    
 C    3.918600       3.164600      0.4280000    
 C   -2.885500     -0.1823000     -0.5261000    
 C   -3.136400       1.720200      0.9417000    
 C   -4.272500     -0.2795000     -0.6373000    
 C   -4.523500       1.622900      0.8306000    
 C    4.033700      0.9264000       1.518300    
 C   0.5869000      -2.619000      0.1660000    
 C    2.049900       3.794900     -0.9675000    
 C    3.277200       4.102800     -0.3808000    
 C   -6.574200      0.5187000     -7.7399999E-02
 C    1.671100      -2.586300     -0.7050000    
 C   0.2584000      -3.789600      0.8421000    
 C    2.435000      -3.736600     -0.9023000    
 C    1.022500      -4.939900      0.6448000    
 C    2.110700      -4.913200     -0.2274000    
 H   0.5095000       2.361100      -1.223000    
 H    4.874300       3.420500      0.8777000    
 H   -2.291200     -0.9072000      -1.070500    
 H   -2.699200       2.500900       1.558300    
 H   -4.703700      -1.064100      -1.253500    
 H   -5.151000       2.330900       1.365400    
 H    4.245700      1.1300000E-02  0.9552000    
 H    4.988200       1.311600       1.892400    
 H    3.414500      0.6777000       2.386600    
 H    1.550900       4.526200      -1.596600    
 H    3.733300       5.073300     -0.5536000    
 H   -7.048300       1.501500      1.7999999E-02
 H   -6.865300      0.1165000      -1.053700    
 H   -6.968300     -0.1382000      0.7042000    
 H    1.963100      -1.696200      -1.250000    
 H  -0.5885000      -3.814600       1.522100    
 H    3.282900      -3.716400      -1.580800    
 H   0.7700000      -5.856200       1.170300    
 H    2.705600      -5.808800     -0.3808000    


%chk=000117798-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117798

0 1
P 0.316106 -0.243596 -0.268665
O 1.840244 0.295165 0.334364
O -0.752009 0.687598 0.720131
O 0.195014 -1.773495 0.518494
O 0.090049 -0.199929 -1.840344
C 2.419520 1.541672 -0.090865
C 2.581891 2.543089 0.899492
C -2.175012 0.694471 0.521390
C -4.990847 0.848331 0.302100
C 2.868081 1.689458 -1.418203
C 3.242712 3.731165 0.496974
C -2.751231 0.959230 -0.738053
C -2.966634 0.506202 1.671176
C -4.159047 1.029584 -0.832526
C -4.370219 0.593189 1.553302
C 2.067070 2.339227 2.308544
C 0.833566 -2.962221 0.032581
C 3.515257 2.889330 -1.787835
C 3.704923 3.909024 -0.827471
C -6.504069 0.901386 0.180310
C 0.834231 -3.317867 -1.333925
C 1.395297 -3.794060 1.022381
C 1.428196 -4.545751 -1.706175
C 1.972345 -5.022432 0.631486
C 1.994205 -5.400024 -0.731914
H 2.705965 0.884037 -2.141121
H 3.389163 4.526820 1.236846
H -2.118106 1.102323 -1.618952
H -2.481730 0.301560 2.630113
H -4.615454 1.234011 -1.808221
H -4.991227 0.454548 2.446308
H 2.574911 1.488754 2.798883
H 2.226634 3.242798 2.920582
H 0.988163 2.099881 2.302477
H 3.867725 3.021883 -2.816083
H 4.208830 4.840276 -1.108056
H -6.967321 1.355292 1.074378
H -6.819344 1.486219 -0.701212
H -6.930295 -0.114853 0.071003
H 0.387242 -2.655497 -2.081902
H 1.371902 -3.473322 2.067758
H 1.439633 -4.834343 -2.762897
H 2.409006 -5.678352 1.392359
H 2.447266 -6.350981 -1.031411


