%chk=000006527.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006527

0 1
 P  -4.3000001E-03 -3.4000000E-03 -0.4936000    
 O    1.427700     -0.3138000      0.1981000    
 O  -0.9893000      -1.082300      0.1992000    
 O  -0.4462000       1.389300      0.1988000    
 O  -4.1999999E-03 -3.4000000E-03  -1.996700    
 C    2.149200      -1.457200      2.9700000E-02
 C   -2.346400      -1.128900      2.8800000E-02
 C   0.1921000       2.587800      2.8500000E-02
 C    3.375600      -1.628200      0.6720000    
 C   -3.107300      -2.100700      0.6723000    
 C  -0.2691000       3.732800      0.6718000    
 C    1.648400      -2.463500     -0.7963000    
 C   -2.956000     -0.1894000     -0.7979000    
 C    1.310800       2.645900     -0.7979000    
 C    4.100900      -2.805500      0.4884000    
 C   -4.489500      -2.133300      0.4876000    
 C   0.3940000       4.946000      0.4871000    
 C    3.927400     -0.5618000       1.559800    
 C   -2.465600      -3.114100       1.561600    
 C   -1.467700       3.684000       1.560700    
 C    2.373600      -3.640900     -0.9798000    
 C   -4.338300     -0.2220000     -0.9824000    
 C    1.973900       3.859100     -0.9824000    
 C    3.599800      -3.811800     -0.3375000    
 C   -5.105000      -1.193900     -0.3398000    
 C    1.515500       5.009100     -0.3401000    
 H   0.7010000      -2.382200      -1.316300    
 H   -2.407800      0.5868000      -1.318200    
 H    1.708800       1.783000      -1.318400    
 H    5.057800      -2.954700      0.9816000    
 H   -5.101500      -2.883700      0.9810000    
 H   5.0099999E-02   5.851200      0.9803000    
 H    4.064100      0.3678000      0.9973000    
 H    3.247800     -0.3769000       2.398300    
 H    4.900600     -0.8399000       1.978100    
 H   -1.963900      -2.619700       2.400000    
 H   -3.196900      -3.813800       1.980000    
 H   -1.731400      -3.701600       1.000400    
 H   -1.708100       4.667300       1.978900    
 H   -2.343500       3.341800      0.9992000    
 H   -1.290800       3.002300       2.399200    
 H    1.983700      -4.425100      -1.622100    
 H   -4.818400      0.5096000      -1.625900    
 H    2.847500       3.908900      -1.625800    
 H    4.164300      -4.728600     -0.4803000    
 H   -6.181200      -1.218900     -0.4835000    
 H    2.032000       5.953700     -0.4838000    


%chk=000006527-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006527

0 1
P 0.007839 0.005496 -0.514697
O 1.527834 -0.220235 0.282203
O -0.945018 -1.193500 0.293774
O -0.546400 1.429202 0.298887
O -0.003057 0.007428 -2.101601
C 2.414392 -1.296051 -0.072086
C -2.313758 -1.436427 -0.075628
C -0.085551 2.739477 -0.072901
C 2.648411 -2.285913 0.915782
C -3.298585 -1.168477 0.908606
C 0.659890 3.455489 0.897763
C 3.061705 -1.286705 -1.323495
C -2.613963 -1.990428 -1.335897
C -0.449053 3.282729 -1.320982
C 3.595060 -3.291177 0.594288
C -4.636169 -1.498886 0.574526
C 1.026230 4.783627 0.563099
C 1.911921 -2.260130 2.238359
C -2.923634 -0.553712 2.240634
C 1.040745 2.817200 2.216988
C 3.992930 -2.308221 -1.614798
C -3.958348 -2.299308 -1.639845
C -0.060436 4.606042 -1.625907
C 4.261167 -3.308764 -0.652931
C -4.968885 -2.056205 -0.681735
C 0.674218 5.357509 -0.680427
H 2.832130 -0.500277 -2.049240
H -1.811816 -2.165386 -2.059514
H -1.016088 2.676874 -2.034536
H 3.804186 -4.072007 1.334855
H -5.424343 -1.308631 1.312385
H 1.600815 5.369116 1.290481
H 2.156159 -1.348541 2.814408
H 0.818280 -2.248602 2.078825
H 2.171489 -3.139712 2.851249
H -2.383527 0.399639 2.094923
H -3.820632 -0.363322 2.853494
H -2.245523 -1.216022 2.809656
H 1.692692 3.485595 2.804149
H 0.144751 2.584579 2.821732
H 1.567799 1.859723 2.052739
H 4.502840 -2.318125 -2.583797
H -4.209722 -2.727039 -2.616028
H -0.332077 5.042653 -2.592670
H 4.984421 -4.101450 -0.872937
H -6.012430 -2.297157 -0.911571
H 0.975311 6.385234 -0.910582


