%chk=000116956.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116956

0 1
 P   -1.880400     -0.8779000     -0.6666000    
 P    3.445100      0.8858000      0.5755000    
 O   -3.205700     -0.3181000      -1.409700    
 O   -2.471200      -1.606700      0.6521000    
 O    4.284700      7.6800004E-02 -0.5483000    
 O    2.849400     -0.2896000       1.515000    
 O   -1.157600      0.4539000     -9.7999997E-02
 O    2.156900       1.448300     -0.2269000    
 O   -1.003600      -1.739200      -1.527600    
 O    4.232200       1.938300       1.299600    
 C   -4.656800     -0.5043000      0.5556000    
 C    3.210900      -2.082400     -0.1150000    
 C  -2.3000001E-03   2.589700     -0.3575000    
 C   -4.178500      0.3650000     -0.6256000    
 C   -3.448300     -0.9145000       1.422500    
 C    3.670300      -1.049900      -1.165200    
 C    2.244200      -1.413400      0.8840000    
 C  -0.6613000       1.376700      -1.050800    
 C    1.158900       2.110900      0.5394000    
 C   -5.648900      0.2976000       1.410200    
 C   -5.359000      -1.765900      1.7999999E-02
 C    2.493800      -3.242600     -0.8200000    
 C    4.436400      -2.631600      0.6405000    
 C   0.5248000       3.571500      -1.421400    
 C   -1.033900       3.321600      0.5201000    
 H   -5.014900      0.6210000      -1.285000    
 H   -3.742500       1.306400     -0.2725000    
 H   -2.972200     -3.8500000E-02   1.878000    
 H   -3.759500      -1.577400       2.237200    
 H    4.400200      -1.491000      -1.852800    
 H    2.825900     -0.6962000      -1.767900    
 H    1.328300      -1.080000      0.3841000    
 H    1.948200      -2.115900       1.670700    
 H   -1.490100       1.713900      -1.683800    
 H   5.8899999E-02  0.8625000      -1.697700    
 H    1.623900       2.967600       1.041500    
 H   0.7961000       1.430600       1.318000    
 H   -5.182700       1.204800       1.810700    
 H   -6.521300      0.6033000      0.8218000    
 H   -6.009000     -0.2945000       2.258900    
 H   -6.227400      -1.499900     -0.5954000    
 H   -4.692400      -2.375700     -0.6009000    
 H   -5.715200      -2.396800      0.8402000    
 H    1.622000      -2.887500      -1.379600    
 H    3.160000      -3.747100      -1.528600    
 H    2.145400      -3.990000     -9.8399997E-02
 H    5.135800      -3.118800     -4.8400000E-02
 H    4.985400      -1.841300       1.163600    
 H    4.135600      -3.374600       1.387700    
 H  -0.2938000       3.956800      -2.039600    
 H    1.024100       4.428600     -0.9559000    
 H    1.244200       3.088200      -2.091400    
 H  -0.5926000       4.205100      0.9950000    
 H   -1.890800       3.656100     -7.5300001E-02
 H   -1.415200       2.674200       1.317600    


%chk=000116956-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116956

0 1
P -1.670443 -0.470432 -0.199998
P 3.515980 0.797146 0.151530
O -2.919765 -0.626740 -1.396169
O -2.438904 -0.934481 1.268255
O 3.779804 -0.148769 -1.259726
O 3.375372 -0.365030 1.428627
O -1.508407 1.222698 0.078751
O 1.895716 1.321304 -0.178574
O -0.370196 -1.294239 -0.553889
O 4.569440 1.932966 0.448610
C -4.790053 -0.770895 0.316990
C 3.109085 -2.339100 -0.156863
C 0.171365 3.044617 -0.073401
C -4.270600 -0.119367 -0.992645
C -3.828980 -0.417399 1.483388
C 2.941796 -1.395796 -1.376614
C 2.594480 -1.611057 1.113144
C -0.720048 2.070700 -0.873540
C 1.204756 2.245929 0.751722
C -6.170481 -0.143195 0.641044
C -4.912932 -2.304494 0.151225
C 2.185736 -3.563784 -0.391104
C 4.582261 -2.779599 0.010599
C 0.895011 3.953917 -1.100424
C -0.682002 3.892208 0.902837
H -4.908441 -0.383149 -1.852130
H -4.221307 0.983419 -0.890298
H -3.774273 0.678314 1.636799
H -4.139539 -0.909061 2.419549
H 3.319313 -1.861105 -2.301703
H 1.882214 -1.101950 -1.495316
H 1.527380 -1.346227 0.990857
H 2.735292 -2.228143 2.015908
H -1.454305 2.627942 -1.483377
H -0.092695 1.427036 -1.516366
H 1.935672 2.934382 1.218947
H 0.702510 1.645528 1.532172
H -6.106767 0.954618 0.766221
H -6.893121 -0.353523 -0.168399
H -6.582862 -0.569063 1.573957
H -5.624710 -2.550509 -0.658074
H -3.941183 -2.762701 -0.098130
H -5.281105 -2.768167 1.084742
H 1.133962 -3.251837 -0.524328
H 2.504008 -4.121579 -1.291588
H 2.239508 -4.259271 0.467215
H 4.934918 -3.304927 -0.896446
H 5.246548 -1.916122 0.184387
H 4.685054 -3.469616 0.868617
H 0.168080 4.501096 -1.729456
H 1.516506 4.701084 -0.574338
H 1.558709 3.364057 -1.756016
H -0.038916 4.557083 1.508566
H -1.389234 4.530641 0.341184
H -1.264709 3.248541 1.584770


