%chk=000085888.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085888

0 1
 P  -0.8423000      -1.382600      0.1964000    
 O  -0.2506000      0.1273000      0.2162000    
 O   -2.008800      -1.147600     -0.9012000    
 O   0.2664000      -2.048300     -0.7784000    
 C    1.003000       1.938800       1.238100    
 C    2.059100       2.027700      0.1164000    
 C  -0.1615000       2.943900       1.091000    
 C    2.724600       3.403500      8.2000000E-03
 C   0.5111000      0.4873000       1.360700    
 C    3.758300       3.485900      -1.118400    
 C   -1.217100       2.876000       2.186100    
 C    4.404100       4.856800      -1.247900    
 C   -3.238600     -0.5912000     -0.6508000    
 C    1.513400      -2.471900     -0.3914000    
 C   -4.102000      -1.191100      0.2661000    
 C    1.642700      -3.464500      0.5802000    
 C   -3.625000      0.5737000      -1.313700    
 C    2.651500      -1.909400     -0.9694000    
 C   -5.351800     -0.6262000      0.5199000    
 C    2.909900      -3.894200      0.9740000    
 C   -4.874900       1.138600      -1.059600    
 C    3.918700      -2.339400     -0.5758000    
 C   -5.738300      0.5386000     -0.1429000    
 C    4.047900      -3.331800      0.3960000    
 H    1.517000       2.175900       2.180200    
 H    1.592900       1.781600     -0.8460000    
 H    2.839000       1.275500      0.2903000    
 H  -0.6487000       2.809500      0.1177000    
 H   0.2396000       3.963200       1.099700    
 H    3.205500       3.650800      0.9623000    
 H    1.967500       4.172300     -0.1787000    
 H  -9.6199997E-02  0.3775000       2.268500    
 H    1.378300     -0.1771000       1.470400    
 H    4.542600       2.739100     -0.9463000    
 H    3.279200       3.230000      -2.071000    
 H  -0.7599000       2.953800       3.177400    
 H   -1.787800       1.944100       2.136000    
 H   -1.927600       3.701400       2.074000    
 H    3.652700       5.623800      -1.460500    
 H    4.924000       5.131700     -0.3247000    
 H    5.133500       4.858200      -2.063800    
 H   -3.822500      -2.105000      0.7831000    
 H   0.7673000      -3.922000       1.033300    
 H   -2.956300       1.046000      -2.028100    
 H    2.557000      -1.134400      -1.725200    
 H   -6.025200      -1.094600       1.231800    
 H    3.010600      -4.668600       1.728800    
 H   -5.175600       2.045800      -1.575400    
 H    4.804800      -1.900700      -1.025100    
 H   -6.711600      0.9782000      5.4400001E-02
 H    5.034600      -3.666700      0.7024000    


%chk=000085888-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000085888

0 1
P -0.181477 -1.429140 0.324119
O 0.818572 -0.019247 0.005974
O -1.349699 -1.149505 -0.974476
O 0.622691 -2.643247 -0.702288
C 1.303566 2.110237 1.174298
C 1.813551 2.772947 -0.135134
C -0.182473 2.445192 1.473207
C 1.766516 4.317614 -0.141168
C 1.572332 0.593696 1.137365
C 2.451730 4.929582 -1.385091
C -0.729716 1.846713 2.787974
C 2.377348 6.471497 -1.416142
C -2.378557 -0.188206 -0.799457
C 1.509803 -3.587701 -0.132083
C -3.297664 -0.272596 0.273729
C 1.227004 -4.273593 1.075207
C -2.499979 0.817074 -1.784122
C 2.683522 -3.872969 -0.867001
C -4.343777 0.673600 0.360863
C 2.139700 -5.243941 1.547612
C -3.558379 1.748120 -1.692157
C 3.579546 -4.853739 -0.389110
C -4.478979 1.684738 -0.618940
C 3.316344 -5.539005 0.821105
H 1.921047 2.498766 2.017521
H 1.229805 2.372872 -0.987150
H 2.864191 2.453036 -0.302426
H -0.802998 2.105699 0.621389
H -0.289057 3.545422 1.518833
H 2.258599 4.708950 0.775028
H 0.716081 4.669086 -0.106947
H 1.288986 0.110666 2.094854
H 2.643585 0.397342 0.944484
H 3.512834 4.607467 -1.412640
H 1.979064 4.516102 -2.299327
H -0.093015 2.120447 3.651479
H -0.792391 0.742703 2.750464
H -1.750539 2.220022 2.988387
H 1.326012 6.816713 -1.422401
H 2.868024 6.910535 -0.526699
H 2.873647 6.884081 -2.313846
H -3.206703 -1.074886 1.014552
H 0.300956 -4.070108 1.624331
H -1.772011 0.847758 -2.599854
H 2.867037 -3.327651 -1.797406
H -5.058799 0.612155 1.188941
H 1.922023 -5.777399 2.479811
H -3.659736 2.525811 -2.457309
H 4.485943 -5.079152 -0.962034
H -5.295582 2.411363 -0.550474
H 4.015972 -6.296725 1.189453


