%chk=000093426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093426

0 1
 P   0.2190000     -2.0000001E-03 -0.3365000    
 O  -0.9424000      0.8728000      0.3706000    
 O    1.571900      0.5784000      0.3386000    
 O   5.5399999E-02  -1.452800      0.3583000    
 O   0.2003000     -1.9000000E-03  -1.839500    
 C   -2.286100      0.6637000      0.2171000    
 C   -2.957500     -0.1944000       1.084600    
 C   -2.975700       1.309900     -0.8059000    
 C   -5.021100      0.2384000     -9.5200002E-02
 C   -4.327100     -0.4074000      0.9281000    
 C   -4.345400       1.097000     -0.9623000    
 C    2.057100       1.841100      0.1636000    
 C   0.9055000      -2.509900      0.1776000    
 C    1.667600       2.864300       1.027800    
 C    2.000200      -2.671500       1.023100    
 C    2.942500       2.109300     -0.8805000    
 C   0.6719000      -3.418500     -0.8517000    
 C   -2.232300     -0.8944000       2.186400    
 C   -2.269800       2.232600      -1.744100    
 C   -6.485500      1.0800000E-02 -0.2623000    
 C    2.163500       4.155600      0.8481000    
 C    2.866800      -3.748700      0.8380000    
 C    3.438600       3.400600      -1.060000    
 C    1.538400      -4.495900      -1.036500    
 C   0.7213000       2.597400       2.151800    
 C    2.264200      -1.706400       2.131500    
 C    3.371200       1.027700      -1.816600    
 C  -0.4973000      -3.258800      -1.766800    
 C    3.049000       4.423800     -0.1957000    
 C    2.635800      -4.661000     -0.1916000    
 H   -4.854000      -1.077000       1.604000    
 H   -4.887600       1.599300      -1.759900    
 H   -1.314800     -0.3767000       2.482400    
 H   -1.989600      -1.919100       1.890300    
 H   -2.859100     -0.9397000       3.084600    
 H   -1.868800       1.672700      -2.594200    
 H   -1.451300       2.766000      -1.249400    
 H   -2.951900       2.998800      -2.129200    
 H   -6.781300      9.5700003E-02  -1.313500    
 H   -6.770100     -0.9935000      6.9700003E-02
 H   -7.048800      0.7458000      0.3212000    
 H    1.865900       4.961900       1.513400    
 H    3.726700      -3.887100       1.488200    
 H    4.127300       3.624200      -1.870600    
 H    1.371900      -5.212800      -1.836200    
 H  -0.2939000       2.893600       1.871800    
 H    1.011500       3.174400       3.037400    
 H   0.7192000       1.547600       2.460300    
 H    2.634500      -2.236800       3.016500    
 H    1.362600      -1.174900       2.451000    
 H    3.023900     -0.9795000       1.829300    
 H    2.666600      0.9480000      -2.649700    
 H    3.439300      5.8300000E-02  -1.312000    
 H    4.365700       1.234900      -2.227300    
 H  -0.2297000      -2.620100      -2.613700    
 H  -0.8247000      -4.228400      -2.158500    
 H   -1.360100      -2.825000      -1.250500    
 H    3.434200       5.429600     -0.3362000    
 H    3.311300      -5.499100     -0.3361000    


%chk=000093426-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093426

0 1
P 0.094502 -0.010123 -0.260121
O -1.180533 0.727312 0.657522
O 1.486220 0.679994 0.516281
O 0.110428 -1.605012 0.432884
O 0.012227 0.104153 -1.842646
C -2.579093 0.551002 0.350936
C -3.314009 -0.360312 1.150209
C -3.174279 1.384117 -0.629276
C -5.352355 0.342310 -0.070115
C -4.706489 -0.450353 0.910630
C -4.570751 1.252142 -0.824010
C 2.078147 1.927916 0.105763
C 1.143865 -2.569814 0.143707
C 1.803210 3.067609 0.904209
C 2.153291 -2.747247 1.124954
C 2.993546 1.923130 -0.977805
C 1.026462 -3.369774 -1.022374
C -2.640184 -1.192132 2.222255
C -2.357255 2.377855 -1.430674
C -6.853376 0.244214 -0.282870
C 2.465474 4.271221 0.556075
C 3.118107 -3.756058 0.880034
C 3.631289 3.151669 -1.283207
C 2.016612 -4.365427 -1.219151
C 0.863562 2.992007 2.090563
C 2.185762 -1.908713 2.385659
C 3.284973 0.662643 -1.766972
C -0.112596 -3.186878 -2.005719
C 3.366729 4.316680 -0.530371
C 3.058219 -4.552789 -0.284432
H -5.297510 -1.153272 1.510725
H -5.055411 1.881505 -1.580767
H -2.170450 -0.545410 2.986487
H -1.830727 -1.813871 1.800421
H -3.370194 -1.849710 2.723426
H -1.646957 1.861509 -2.102252
H -1.755371 3.027371 -0.768321
H -3.013384 3.019408 -2.042143
H -7.130709 0.472962 -1.326861
H -7.230886 -0.765236 -0.042523
H -7.395123 0.960493 0.365417
H 2.272709 5.172162 1.149798
H 3.914505 -3.915939 1.615797
H 4.342740 3.184927 -2.116240
H 1.957736 -4.998654 -2.111839
H -0.117555 2.571229 1.808572
H 0.710410 3.991401 2.531440
H 1.272170 2.326811 2.874371
H 3.036333 -2.197905 3.025598
H 1.253209 -2.032372 2.966851
H 2.267599 -0.833775 2.146327
H 2.399195 0.343534 -2.346855
H 3.552146 -0.176739 -1.098914
H 4.118893 0.826730 -2.469617
H -0.061178 -2.204578 -2.509409
H -0.091067 -3.976676 -2.775002
H -1.090939 -3.226280 -1.492279
H 3.868831 5.256688 -0.784275
H 3.814180 -5.326753 -0.456774


