%chk=000116439.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116439

0 1
 P    2.589600     -0.5097000      0.6909000    
 O    1.142300     -0.1040000      9.2100002E-02
 O    3.340800      -1.154700     -0.5916000    
 O    3.341100      0.9062000      0.9298000    
 O    2.541800      -1.399100       1.900800    
 C   -1.050000      0.9019000      0.2316000    
 C   -2.140200      1.7300000E-02  0.2690000    
 C   -3.331500      0.3581000     -0.4147000    
 C   0.2393000      0.6033000      0.9328000    
 C   -1.133000       2.104900     -0.4702000    
 C   -2.074300      -1.197700      0.9703000    
 C   -3.397500       1.573300      -1.115700    
 C   -2.304600       2.440100      -1.142400    
 C   -4.421800     -0.5262000     -0.3773000    
 C   -3.167300      -2.064400      0.9967000    
 C   -4.338800      -1.729400      0.3240000    
 C    2.827400      -2.356200      -1.140800    
 C    3.456200       1.839000     -0.1313000    
 C    3.684300      -2.765200      -2.319900    
 C    4.196300       3.062500      0.3658000    
 H   0.7150000       1.546100       1.231000    
 H   9.5799997E-02  6.0699999E-02   1.872000    
 H  -0.2903000       2.790700     -0.5049000    
 H   -1.182600      -1.522100       1.497800    
 H   -4.303200       1.855700      -1.648600    
 H   -2.368500       3.376400      -1.689200    
 H   -5.347500     -0.2849000     -0.8959000    
 H   -3.102400      -3.003400       1.538800    
 H   -5.188900      -2.405200      0.3440000    
 H    2.840600      -3.137200     -0.3741000    
 H    1.794100      -2.196700      -1.464300    
 H    4.006500       1.381000     -0.9587000    
 H    2.461200       2.122300     -0.4858000    
 H    3.315500      -3.691900      -2.768200    
 H    3.689000      -1.980300      -3.083400    
 H    4.723700      -2.912300      -2.008500    
 H    4.306300       3.803300     -0.4311000    
 H    3.661600       3.521700       1.203900    
 H    5.190600       2.788900      0.7340000    


%chk=000116439-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116439

0 1
P 2.308962 -0.077400 0.748493
O 1.121375 1.044549 0.153307
O 2.730297 -0.873181 -0.716649
O 3.744999 0.801949 1.045410
O 1.824311 -0.930052 1.997279
C -1.314471 1.274019 0.368336
C -1.953042 -0.024294 0.326815
C -3.218419 -0.156274 -0.372470
C 0.005211 1.485801 1.068487
C -1.928097 2.368374 -0.256157
C -1.393689 -1.190829 0.952466
C -3.804917 0.992496 -0.999932
C -3.173534 2.234828 -0.942047
C -3.868025 -1.434267 -0.419991
C -2.055086 -2.420927 0.891351
C -3.300329 -2.548824 0.199472
C 1.679284 -1.663449 -1.434906
C 4.375255 1.599021 -0.058538
C 2.354986 -2.230232 -2.678107
C 5.549886 2.331199 0.580574
H 0.182130 2.558411 1.252207
H 0.084144 0.928739 2.020234
H -1.439006 3.349330 -0.219960
H -0.439920 -1.128760 1.489849
H -4.761622 0.878402 -1.523876
H -3.626488 3.110625 -1.418578
H -4.824502 -1.518989 -0.949962
H -1.615868 -3.296193 1.382659
H -3.804962 -3.520497 0.162250
H 1.315262 -2.463342 -0.762964
H 0.841309 -0.987732 -1.686187
H 4.696003 0.900076 -0.850971
H 3.621554 2.297215 -0.469398
H 1.627879 -2.831805 -3.254469
H 2.726891 -1.417916 -3.325444
H 3.204284 -2.877392 -2.401201
H 6.075660 2.933001 -0.184135
H 5.203515 3.005100 1.382125
H 6.265381 1.612019 1.013329


