%chk=000105576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105576

0 1
 P  -3.3300001E-02   2.914400      6.6900000E-02
 O  -0.5369000      -1.754200     -9.4099998E-02
 O  -0.9624000       1.656000      0.4775000    
 O   -3.958100      -2.016400     -0.7715000    
 O   -4.403600       1.256700      0.3803000    
 O   0.2768000      -3.040400       1.639200    
 O   0.9881000       2.269300      -1.008000    
 O   -1.005600       3.828800     -0.8461000    
 O   0.6208000       3.623200       1.216700    
 C   -2.462600     -0.2361000      6.3000000E-03
 C   -1.559600      -1.240600      0.7655000    
 C   -1.616100      0.9335000     -0.5569000    
 C   -3.153300     -0.9243000      -1.197700    
 C   -3.551300      0.2889000      0.9784000    
 C    2.210000      -1.999800      -1.082500    
 C    3.048000      -1.358700      2.8000001E-02
 C    1.310200      -3.120500     -0.5616000    
 C    3.958000     -0.2613000     -0.5274000    
 C   0.3177000      -2.652400      0.4798000    
 C    4.815600      0.3602000      0.5746000    
 C    5.697700       1.473700      3.2600001E-02
 H   -2.158500      -2.077400       1.146000    
 H   -1.084900     -0.7456000       1.622000    
 H  -0.8622000      0.5519000      -1.254400    
 H   -2.256800       1.624300      -1.116500    
 H   -3.796600     -0.2208000      -1.738200    
 H   -2.411600      -1.308600      -1.907100    
 H   -4.177000     -0.5325000       1.345300    
 H   -3.083800      0.7567000       1.852600    
 H    2.874700      -2.412600      -1.850800    
 H    1.600500      -1.228400      -1.568800    
 H    3.656100      -2.128600      0.5181000    
 H    2.392700     -0.9265000      0.7933000    
 H   0.7523000      -3.580900      -1.384800    
 H    1.921800      -3.912000     -0.1126000    
 H    3.347400      0.5158000      -1.002300    
 H    4.608600     -0.6804000      -1.304600    
 H   -4.359200      -2.403600      -1.568200    
 H   -5.045000       1.530700       1.057800    
 H    5.446800     -0.4091000       1.034200    
 H    4.171400      0.7658000       1.363600    
 H    5.093300       2.275500     -0.4036000    
 H    6.376500       1.096100     -0.7386000    
 H    6.302700       1.903500      0.8370000    
 H    1.730900       2.814600      -1.344200    
 H  -0.6782000       4.696100      -1.166500    


%chk=000105576-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000105576

0 1
P 0.219826 2.808171 0.736145
O -0.512427 -1.845409 0.018308
O -0.821262 1.465292 0.765774
O -3.765425 -1.993215 -0.950052
O -4.170604 1.364908 -0.144486
O -0.027544 -3.259169 1.801356
O 1.530688 2.438063 -0.337422
O -0.656825 3.851607 -0.306409
O 0.643359 3.306896 2.174198
C -2.341559 -0.230321 -0.080171
C -1.650484 -1.286787 0.803527
C -1.358016 0.878956 -0.502417
C -2.894610 -0.882981 -1.372042
C -3.507935 0.381722 0.731914
C 2.148488 -2.293259 -0.992013
C 2.920225 -1.366478 -0.026712
C 1.325640 -3.385720 -0.266145
C 3.704620 -0.257482 -0.763248
C 0.228266 -2.852772 0.645509
C 4.462109 0.694627 0.192397
C 5.161804 1.863424 -0.536732
H -2.343174 -2.108614 1.047909
H -1.251752 -0.841006 1.730650
H -0.513491 0.466648 -1.081966
H -1.882216 1.670485 -1.063027
H -3.466060 -0.122572 -1.938514
H -2.054356 -1.268444 -1.983838
H -4.216897 -0.421960 1.008093
H -3.102926 0.869020 1.640009
H 2.864173 -2.791610 -1.676114
H 1.469037 -1.687791 -1.621016
H 3.618335 -1.968889 0.590522
H 2.203609 -0.899254 0.680099
H 0.841738 -4.042403 -1.016420
H 1.976125 -4.022981 0.358107
H 3.002795 0.327082 -1.394659
H 4.434186 -0.717861 -1.460666
H -4.348867 -2.257930 -1.701720
H -4.704099 1.989463 0.403430
H 5.209912 0.115528 0.770060
H 3.761787 1.089228 0.966223
H 4.438822 2.473386 -1.111904
H 5.913508 1.483010 -1.252863
H 5.681193 2.531776 0.173696
H 2.342215 2.071297 0.103059
H -0.149930 4.628319 -0.651728


