%chk=000157386.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157386

0 1
 P    3.377400      -1.710700      0.5979000    
 P    4.080000       1.064200     -8.9000002E-02
 P    1.834300       2.833900     -0.8161000    
 F  -0.9161000     -0.8273000      -1.528700    
 O   -1.601600      -2.138600       1.086100    
 O   -1.167400      -4.332700      -1.090300    
 O    1.958600      -2.468100      0.4198000    
 O   -5.012200     -0.9578000     -0.9112000    
 O    3.139800     -0.2475000     -4.4399999E-02
 O    3.474500      -1.407100       2.184000    
 O    4.559100      -2.445000      3.4299999E-02
 O   -4.325400       3.300600      0.6835000    
 O    3.251500       2.086300      -1.026800    
 O    5.321700      0.6186000      -1.023300    
 O    4.466900       1.619300       1.250000    
 O    1.588100       3.559000      -2.239700    
 O   0.7628000       1.624200     -0.8195000    
 O    1.776100       3.739200      0.3789000    
 N   -2.973800     -0.4987000      0.1315000    
 N   -4.656200       1.162200     -0.1119000    
 C  -0.6034000      -3.042300     -0.8780000    
 C  -0.4064000      -2.790200      0.6133000    
 C   -1.595300      -1.979300      -1.280500    
 C   -2.440900      -1.818200     -3.1599998E-02
 C   0.7710000      -1.871600      0.9124000    
 C   -2.194200      0.4631000      0.7679000    
 C   -4.264600     -0.1617000     -0.3390000    
 C   -2.572000       1.729200      0.9837000    
 C   -3.918100       2.154100      0.5161000    
 C   -1.714200       2.742700       1.670700    
 H   0.3220000      -2.986300      -1.458300    
 H  -0.2883000      -3.731600       1.161700    
 H   -2.194000      -2.219000      -2.163800    
 H   -3.255800      -2.552000     -3.5999998E-02
 H   0.8544000      -1.708400       1.992200    
 H   0.6434000     -0.8926000      0.4437000    
 H  -0.5180000      -4.987900     -0.7827000    
 H   -1.212000      0.1557000       1.101600    
 H   -5.580900       1.423600     -0.4426000    
 H  -0.7503000       2.323000       1.977700    
 H   -2.213000       3.121000       2.568800    
 H   -1.510900       3.586500       1.003200    
 H    3.754200      -2.127300       2.788400    
 H    6.027800      5.7100002E-02 -0.6380000    
 H   0.8217000       4.163100      -2.338400    
 H  -0.1845000       1.833400     -0.6807000    


%chk=000157386-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157386

0 1
P 3.582830 -2.389723 0.764405
P 4.358230 0.412942 -0.288767
P 1.542245 1.818987 -0.518237
F -1.162832 -0.192144 -1.754747
O -1.412578 -1.552555 1.190792
O -0.008451 -3.473976 -1.522752
O 1.988650 -2.936528 0.924090
O -5.064612 -1.349024 -0.465088
O 3.291911 -0.944530 -0.295016
O 3.932264 -1.669474 2.262437
O 4.563864 -3.433804 0.115376
O -5.380220 3.187747 0.625897
O 3.284335 1.687453 -0.564378
O 5.202570 0.474726 -1.758540
O 5.237981 0.426210 1.041340
O 1.464979 3.505395 -0.611812
O 1.147480 1.194827 -2.036891
O 0.806447 1.203739 0.737191
N -3.111868 -0.211503 0.206243
N -5.170291 0.923643 0.107065
C -0.151931 -2.231271 -0.781071
C -0.332870 -2.457028 0.755035
C -1.457285 -1.552153 -1.225402
C -2.344883 -1.440091 0.051016
C 0.916219 -2.101769 1.562004
C -2.491535 0.975694 0.630076
C -4.501875 -0.286911 -0.075337
C -3.178296 2.153706 0.794773
C -4.624011 2.180451 0.521732
C -2.517984 3.430378 1.253425
H 0.704170 -1.552320 -0.964362
H -0.631764 -3.512780 0.918250
H -1.950146 -2.080112 -2.054728
H -3.070285 -2.276982 0.041472
H 0.842574 -2.403097 2.617657
H 1.138341 -1.022975 1.477796
H 0.837857 -3.910055 -1.244648
H -1.423348 0.892444 0.846076
H -6.176458 0.909714 -0.089164
H -1.439652 3.281695 1.430279
H -2.985518 3.798909 2.184403
H -2.649082 4.229789 0.501686
H 4.581322 -0.891799 2.194754
H 6.090554 0.029644 -1.754161
H 2.147916 3.946954 -1.180224
H 0.290837 0.665658 -2.073042


