%chk=000105219.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105219

0 1
 P   -3.601000      0.8544000      0.6745000    
 P    3.601300      0.8534000      0.6778000    
 O   -3.179500     -0.6952000      0.8677000    
 O   -5.196700      0.7838000      0.4200000    
 O    5.196400      0.7849000      0.4183000    
 O    3.182500     -0.6967000      0.8718000    
 O   -3.205400       1.740600       1.820300    
 O    3.208300       1.738800       1.825100    
 C   -5.252500      -1.618900     -5.4299999E-02
 C    5.253800      -1.617500     -5.7100002E-02
 C   -3.712000      -1.673800     -1.7400000E-02
 C   -5.714900     -0.2054000     -0.4616000    
 C    5.712900     -0.2032000     -0.4656000    
 C    3.713400      -1.674400     -1.5100000E-02
 C   -5.775200      -2.640500      -1.074600    
 C   -5.814900      -1.964700       1.338200    
 C    5.774300      -2.638100      -1.079400    
 C    5.821100      -1.962800       1.333500    
 C   -2.889000       1.355200     -0.8803000    
 C    2.883500       1.353700     -0.8745000    
 C   -1.387100       1.354900     -0.8795000    
 C    1.392200       1.353800     -0.8764000    
 C  -0.7005000      0.2051000      -1.249500    
 C   0.6944000      0.2044000      -1.247700    
 C  -0.7002000       2.504400     -0.5079000    
 C   0.6947000       2.503800     -0.5064000    
 H   -3.367000      -2.654100      0.3292000    
 H   -3.293800      -1.520900      -1.016400    
 H   -5.406900      3.6800001E-02  -1.484000    
 H   -6.807700     -0.1329000     -0.4311000    
 H    6.805700     -0.1293000     -0.4386000    
 H    5.401400      3.9000001E-02  -1.487000    
 H    3.291500      -1.522000      -1.012600    
 H    3.370900      -2.655300      0.3326000    
 H   -6.869800      -2.627700      -1.122500    
 H   -5.395400      -2.425600      -2.079800    
 H   -5.464000      -3.657600     -0.8114000    
 H   -5.506400      -2.969900       1.647100    
 H   -5.471500      -1.263600       2.106300    
 H   -6.910600      -1.940900       1.335700    
 H    5.391000      -2.423500      -2.083200    
 H    5.465300      -3.655700     -0.8153000    
 H    6.868700      -2.623900      -1.130700    
 H    6.916700      -1.937400       1.327500    
 H    5.515000      -2.968500       1.643200    
 H    5.479100      -1.262500       2.102900    
 H   -3.252300       2.362000      -1.120800    
 H   -3.242700      0.7239000      -1.702300    
 H    3.239800      0.7233000      -1.696200    
 H    3.249300       2.359900      -1.114500    
 H   -1.226600     -0.6943000      -1.551800    
 H    1.219000     -0.6967000      -1.548900    
 H   -1.233600       3.404500     -0.2151000    
 H    1.226500       3.404800     -0.2121000    


%chk=000105219-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000105219

0 1
P -3.735284 0.878709 0.570861
P 3.735707 0.880934 0.569899
O -3.293311 -0.808149 0.712232
O -5.454327 0.830760 0.216126
O 5.454462 0.832750 0.214027
O 3.293350 -0.805891 0.710722
O -3.407323 1.715964 1.871608
O 3.408763 1.717694 1.871227
C -5.567838 -1.702126 0.025790
C 5.567404 -1.700080 0.023061
C -4.025295 -1.812235 -0.100055
C -6.012943 -0.324506 -0.532101
C 6.012594 -0.322435 -0.534662
C 4.024794 -1.809778 -0.102278
C -6.198037 -2.802076 -0.865241
C -6.011965 -1.870179 1.498000
C 6.197057 -2.799985 -0.868426
C 6.011966 -1.868528 1.495087
C -2.940976 1.523320 -1.023922
C 2.940627 1.526669 -1.024067
C -1.427266 1.501309 -0.996367
C 1.426971 1.502926 -0.996553
C -0.705414 0.660010 -1.877183
C 0.705982 0.660819 -1.877293
C -0.704639 2.331264 -0.098839
C 0.703497 2.332048 -0.098935
H -3.661858 -2.778126 0.289727
H -3.722614 -1.721131 -1.166651
H -5.733211 -0.240989 -1.605388
H -7.104644 -0.193815 -0.438658
H 7.104351 -0.191982 -0.441559
H 5.732504 -0.238614 -1.607834
H 3.721774 -1.718149 -1.168733
H 3.661301 -2.775761 0.287223
H -7.301568 -2.750272 -0.827169
H -5.888533 -2.705676 -1.924122
H -5.898583 -3.806142 -0.513062
H -5.699925 -2.856989 1.886861
H -5.568981 -1.094751 2.144654
H -7.112071 -1.798904 1.582274
H 5.887014 -2.703444 -1.927136
H 5.897704 -3.804065 -0.516205
H 7.300613 -2.748284 -0.830930
H 7.112113 -1.797488 1.579038
H 5.699843 -2.855353 1.883842
H 5.569333 -1.093144 2.142041
H -3.337730 2.551033 -1.113826
H -3.344391 0.926000 -1.859693
H 3.344862 0.930935 -1.860567
H 3.336189 2.554963 -1.112546
H -1.246134 0.005892 -2.572290
H 1.247346 0.007327 -2.572490
H -1.249007 2.959096 0.615384
H 1.247246 2.960525 0.615201


