%chk=000012684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012684

0 1
 P  -0.4681000     -0.9878000      0.2870000    
 P    1.682500      0.3966000      -1.204000    
 O   -1.052100      0.3938000      0.9003000    
 O   -1.780800      -1.730500     -0.3050000    
 O   0.3519000     -0.5065000      -1.022600    
 O    1.140800       1.756400     -0.5062000    
 O    2.520300     -0.1822000      5.8699999E-02
 O   0.3233000      -1.817300       1.257900    
 C   -1.938900      0.3204000       2.003300    
 C   -2.618600      -1.061700      -1.232200    
 C   -2.349100       1.722500       2.400300    
 C   -3.760000      -1.979000      -1.616400    
 C   0.3259000       2.591600      -1.316300    
 C    3.518000      -1.148800     -0.2393000    
 C  -8.7800004E-02   3.806100     -0.5129000    
 C    4.192900      -1.573700       1.047400    
 H   -2.820700     -0.2667000       1.730200    
 H   -1.432600     -0.1745000       2.838000    
 H   -3.010700     -0.1441000     -0.7842000    
 H   -2.037700     -0.7974000      -2.121100    
 H   -1.471200       2.319600       2.668100    
 H   -2.837800       2.232200       1.563400    
 H   -3.035500       1.702700       3.251400    
 H   -4.340800      -2.262000     -0.7323000    
 H   -3.378300      -2.906000      -2.056800    
 H   -4.425800      -1.494200      -2.335800    
 H  -0.5751000       2.055100      -1.639900    
 H   0.8814000       2.920900      -2.203600    
 H    4.269900     -0.7240000     -0.9164000    
 H    3.066400      -2.028500     -0.7151000    
 H  -0.6392000       3.506500      0.3839000    
 H   0.7924000       4.362200     -0.1737000    
 H  -0.7183000       4.472600      -1.107900    
 H    4.647300     -0.7119000       1.547400    
 H    3.462400      -1.997200       1.744700    
 H    4.969300      -2.319300      0.8544000    


%chk=000012684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012684

0 1
P -0.787295 -1.392780 0.038874
P 1.630908 0.353628 -1.220253
O -1.501604 -0.069208 0.891163
O -2.121884 -1.993428 -0.837997
O 0.159524 -0.672567 -1.228124
O 1.010078 1.856699 -0.555348
O 2.357129 -0.037122 0.317667
O -0.034592 -2.481878 0.909022
C -0.764790 0.505624 2.067764
C -2.908294 -1.083113 -1.728077
C -1.706140 1.535697 2.682159
C -3.938435 -1.970158 -2.418899
C 0.097441 2.672269 -1.401670
C 3.041220 -1.361672 0.489688
C -0.111702 3.993550 -0.665356
C 3.891189 -1.242416 1.750710
H -0.532197 -0.317366 2.768338
H 0.173112 0.964737 1.705813
H -3.381164 -0.304115 -1.101936
H -2.215504 -0.611004 -2.449500
H -1.941534 2.331623 1.954359
H -2.649979 1.064653 3.005299
H -1.224877 2.000476 3.562767
H -4.590731 -2.458858 -1.675878
H -3.439700 -2.752654 -3.014918
H -4.567956 -1.359457 -3.092879
H -0.857713 2.126617 -1.527690
H 0.551547 2.838056 -2.400194
H 3.665616 -1.578149 -0.400683
H 2.256562 -2.133008 0.597197
H -0.556246 3.814271 0.328645
H 0.848310 4.518882 -0.527308
H -0.793179 4.646764 -1.241354
H 4.650316 -0.448503 1.646082
H 3.253533 -1.008323 2.619951
H 4.404630 -2.201865 1.947265


