%chk=000099401.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099401

0 1
 P  -4.2700000E-02  0.4791000      0.7096000    
 O  -0.1252000       1.377700       1.893600    
 C   -1.567100      0.4902000     -0.2457000    
 C   -2.032100       1.885200     -0.6360000    
 C   -2.767500     -5.8200002E-02  0.5137000    
 C   -3.486200       1.687800      -1.036300    
 C   -3.988100      0.5086000     -0.2045000    
 C   0.2244000      -1.226000       1.112000    
 C    1.219600      0.9254000     -0.4515000    
 C   0.2846000      -2.139000     -0.1055000    
 C    2.602600       1.061000      0.1717000    
 C   0.4562000      -3.607300      0.2823000    
 C    3.653100       1.504200     -0.8462000    
 C   0.5376000      -4.500100     -0.9462000    
 C    5.030800       1.611300     -0.2110000    
 H   -1.425400     -8.6999997E-02  -1.166900    
 H   -1.965200       2.569300      0.2180000    
 H   -1.436900       2.312500      -1.448200    
 H   -2.780400      -1.152100      0.5363000    
 H   -2.753700      0.2878000       1.554100    
 H   -4.080800       2.591400     -0.8706000    
 H   -3.552200       1.440400      -2.102400    
 H   -4.442300     -0.2459000     -0.8566000    
 H   -4.752000      0.8212000      0.5152000    
 H  -0.5746000      -1.561600       1.782500    
 H    1.158100      -1.314700       1.678600    
 H   0.9460000       1.896800     -0.8807000    
 H    1.250600      0.2309000      -1.295900    
 H  -0.6261000      -2.042000     -0.7030000    
 H    1.121000      -1.848800     -0.7487000    
 H    2.560200       1.781300      0.9972000    
 H    2.896800      0.1006000      0.6105000    
 H    1.368100      -3.730900      0.8780000    
 H  -0.3859000      -3.928300      0.9063000    
 H    3.694000      0.7877000      -1.674700    
 H    3.374500       2.475900      -1.270000    
 H    1.390100      -4.225300      -1.575400    
 H  -0.3734000      -4.423000      -1.548400    
 H   0.6594000      -5.545800     -0.6470000    
 H    5.352300      0.6462000      0.1937000    
 H    5.031600       2.343200      0.6030000    
 H    5.767400       1.930000     -0.9552000    


%chk=000099401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099401

0 1
P -0.149584 0.429087 0.642232
O -0.234644 1.347538 1.977859
C -1.765628 0.451406 -0.351377
C -2.104043 1.862575 -0.901876
C -2.988436 0.064563 0.543357
C -3.631481 1.780028 -1.138053
C -4.154814 1.018145 0.111002
C 0.203118 -1.389473 1.042353
C 1.211052 0.991677 -0.547054
C 0.400971 -2.331365 -0.163170
C 2.600749 0.999644 0.124083
C 0.647584 -3.795702 0.275124
C 3.683503 1.652454 -0.767288
C 0.848514 -4.751573 -0.920074
C 5.078108 1.644716 -0.104893
H -1.654102 -0.260568 -1.193272
H -1.880745 2.625421 -0.129560
H -1.538243 2.118134 -1.815934
H -3.254301 -0.999429 0.411131
H -2.744006 0.223141 1.610278
H -4.099051 2.773757 -1.258078
H -3.836554 1.199491 -2.058861
H -5.089545 0.467996 -0.097917
H -4.369863 1.736640 0.922893
H -0.646621 -1.721796 1.668982
H 1.096057 -1.384125 1.695909
H 0.933137 2.015578 -0.860602
H 1.191275 0.346581 -1.446541
H -0.489525 -2.302668 -0.824228
H 1.260793 -1.992464 -0.776877
H 2.531547 1.547421 1.084787
H 2.911768 -0.036789 0.369993
H 1.537010 -3.831457 0.936004
H -0.209572 -4.139505 0.888534
H 3.730026 1.123403 -1.741336
H 3.384171 2.696213 -0.991893
H 1.717676 -4.446359 -1.533042
H -0.040433 -4.758531 -1.578904
H 1.023840 -5.788619 -0.580574
H 5.414709 0.611046 0.101427
H 5.061357 2.189823 0.857324
H 5.835428 2.123640 -0.752171


