%chk=000068934.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068934

0 1
 P    3.372500       1.202200      0.2811000    
 O   0.3648000      -1.224700      -1.077900    
 O    2.860700     -5.5900000E-02   1.176600    
 O    2.025200       1.387300     -0.6128000    
 O    3.318300       2.446200       1.311200    
 O    1.395900      -3.819400     -0.7484000    
 O    4.653400       1.018600     -0.4725000    
 O   -1.978100       2.106400      -1.473700    
 N   -1.392000      0.1463000     -0.4060000    
 N   -3.596400       1.111800     -0.2312000    
 N   -5.249400      8.8600002E-02   1.045100    
 C    1.528100     -0.4054000      0.8096000    
 C   0.9242000      0.7809000      8.0100000E-02
 C    1.512100      -1.488500     -0.2566000    
 C  -4.1000001E-02  0.1419000     -0.8980000    
 C    1.414600      -2.889300      0.3202000    
 C   -1.801900     -0.8870000      0.4222000    
 C   -2.310800       1.172700     -0.7414000    
 C   -3.033000     -0.9630000      0.9239000    
 C   -3.967200      0.1302000      0.5485000    
 H   0.9482000     -0.6744000       1.698000    
 H   0.4871000       1.536500      0.7398000    
 H    2.392600      -1.429000     -0.9089000    
 H  -4.6999999E-03  0.6348000      -1.875800    
 H   0.5052000      -3.038600      0.9065000    
 H    2.280400      -3.104800      0.9546000    
 H   -1.096500      -1.656600      0.6881000    
 H    3.485400       3.351300      0.9721000    
 H    1.347400      -4.707400     -0.3552000    
 H   -3.358100      -1.762600       1.576200    
 H   -5.567100     -0.6597000       1.652200    
 H   -5.920500      0.8136000      0.8150000    


%chk=000068934-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068934

0 1
P 3.452556 1.327072 -0.005147
O 0.350111 -1.315328 -0.996441
O 2.948045 0.108515 1.163569
O 1.873709 1.461857 -0.757107
O 3.627810 2.665250 1.053109
O 1.706424 -3.900742 -0.503099
O 4.672275 1.071588 -0.975388
O -1.608624 2.334462 -0.583307
N -1.524380 0.015507 -0.283322
N -3.527142 1.270420 0.278593
N -5.399815 0.176043 1.099131
C 1.580390 -0.335459 0.838467
C 0.836133 0.798454 0.075783
C 1.568333 -1.520848 -0.159793
C -0.139477 0.054674 -0.860877
C 1.530220 -2.878785 0.527777
C -2.148555 -1.171531 0.033624
C -2.233613 1.299704 -0.208938
C -3.447574 -1.180466 0.504112
C -4.111246 0.101244 0.624480
H 1.095860 -0.574487 1.799004
H 0.346233 1.555280 0.703712
H 2.449662 -1.477355 -0.828492
H -0.183683 0.553022 -1.843368
H 0.564801 -3.001443 1.066595
H 2.360091 -2.901519 1.268222
H -1.563939 -2.078065 -0.138994
H 4.326905 3.312421 0.775741
H 1.796959 -4.790997 -0.080081
H -3.944224 -2.121546 0.747551
H -5.921167 -0.650666 1.377062
H -5.833678 1.096726 1.150419


