%chk=000085311.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085311

0 1
 P    1.587400     -4.3299999E-02 -0.7646000    
 O    2.841400     -0.5661000      0.1040000    
 O    1.600700       1.556600     -0.5625000    
 O    1.570000     -0.4837000      -2.190500    
 C   -1.179700     -9.7599998E-02 -0.4005000    
 C   -2.382700     -0.6393000      0.3733000    
 C   0.1418000     -0.6035000      0.1627000    
 C   -3.696600     -9.9299997E-02 -0.1954000    
 C   -4.898300     -0.6141000      0.5965000    
 C   -6.203700     -5.3100001E-02  5.5300001E-02
 C    2.993600      -1.955200      0.3365000    
 C    1.701200       2.136700      0.7257000    
 C    4.236900      -2.182500       1.169700    
 C    1.688200       3.644400      0.5899000    
 H   -1.184500      0.9985000     -0.3769000    
 H   -1.256800     -0.3862000      -1.455500    
 H   -2.385400      -1.735100      0.3308000    
 H   -2.295300     -0.3560000       1.429200    
 H   0.1296000      -1.698400      0.1293000    
 H   0.2413000     -0.3218000       1.215600    
 H   -3.793000     -0.3967000      -1.246800    
 H   -3.683600      0.9972000     -0.1697000    
 H   -4.797900     -0.3331000       1.651300    
 H   -4.930700      -1.709000      0.5539000    
 H   -6.350800     -0.3413000     -0.9905000    
 H   -6.216300       1.039800      0.1159000    
 H   -7.049700     -0.4351000      0.6351000    
 H    3.076200      -2.475100     -0.6229000    
 H    2.126000      -2.341900      0.8769000    
 H    2.631000       1.811200       1.201600    
 H   0.8570000       1.821500       1.343900    
 H    4.163600      -1.651600       2.124700    
 H    5.121700      -1.792200      0.6560000    
 H    4.385300      -3.247600       1.368200    
 H   0.7664000       3.979600      0.1028000    
 H    2.520200       3.982200     -3.6800001E-02
 H    1.765400       4.125800       1.568700    


%chk=000085311-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085311

0 1
P 1.336529 -0.664070 -0.525262
O 2.501354 -1.274281 0.622238
O 1.583871 1.068394 -0.522014
O 1.459074 -1.229920 -2.005727
C -1.474974 -0.334310 -0.270512
C -2.786167 -0.671824 0.475950
C -0.248947 -0.977456 0.411011
C -4.029062 -0.025662 -0.176875
C -5.345088 -0.359425 0.562248
C -6.583369 0.288786 -0.093623
C 3.831439 -1.734036 0.124939
C 1.716961 1.793060 0.769834
C 4.874047 -1.351169 1.173682
C 2.164646 3.211518 0.423729
H -1.346814 0.765352 -0.318752
H -1.542890 -0.688187 -1.317912
H -2.919497 -1.773235 0.506864
H -2.710174 -0.335784 1.531482
H -0.352545 -2.076140 0.465224
H -0.103137 -0.601132 1.439557
H -4.106683 -0.360998 -1.231855
H -3.897364 1.076062 -0.209791
H -5.265990 -0.025037 1.617049
H -5.475667 -1.460477 0.594040
H -6.702627 -0.053015 -1.139035
H -6.491751 1.391288 -0.110588
H -7.510494 0.035191 0.452477
H 4.046639 -1.277498 -0.859551
H 3.769800 -2.829489 -0.007466
H 2.455213 1.273592 1.411078
H 0.736723 1.801453 1.290859
H 4.612420 -1.780854 2.156026
H 4.944146 -0.254386 1.277584
H 5.867157 -1.738636 0.878266
H 1.427775 3.700088 -0.236022
H 3.135781 3.191894 -0.099036
H 2.269565 3.815042 1.344783


