%chk=000126365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126365

0 1
 P    2.492500       1.819600      -1.220400    
 P    3.056600     -0.5803000      0.3883000    
 P   0.9987000     -0.9187000       2.474900    
 F   -3.700000       2.691300      0.9271000    
 O   -1.819700       1.666300      -1.289300    
 O   -1.319800       3.562700       1.719900    
 O   0.9244000       1.854200     -0.8227000    
 O    2.941500      0.2884000     -0.9677000    
 O    2.501000       1.946300      -2.833100    
 O    3.344200       2.834500     -0.5147000    
 O    1.590600     -0.4339000       1.051500    
 O    3.995400      0.3210000       1.347000    
 O    3.519700      -1.995400      0.2034000    
 O  -0.5729000     -0.5588000       2.359300    
 O    1.024700      -2.531000       2.367500    
 O    1.697900     -0.3441000       3.671600    
 N   -2.495200     -0.4062000     -0.3442000    
 N   -2.730800      -2.551300      0.2196000    
 N  -0.4747000     -0.5487000      -1.685400    
 N   0.3472000      -2.843400      -1.810400    
 N  -0.7583000      -4.665200     -0.7216000    
 C   -1.374600       2.426100      0.8854000    
 C   -1.262600       2.789200     -0.5842000    
 C   -2.779300       1.026200     -0.4219000    
 C   -2.720800       1.741000      0.9218000    
 C   0.1640000       3.029900      -1.042900    
 C   -1.451300      -1.068400     -0.9265000    
 C   -3.234600      -1.340200      0.3334000    
 C   -1.615900      -2.396100     -0.5653000    
 C  -0.6682000      -3.298600      -1.037700    
 C   0.3803000      -1.516300      -2.082300    
 H  -0.5943000       1.721900       1.188100    
 H   -1.865900       3.676000     -0.8165000    
 H   -3.767900       1.116700     -0.8860000    
 H   -2.874200       1.116300       1.804900    
 H   0.6200000       3.866200     -0.5045000    
 H   0.1777000       3.246900      -2.115800    
 H  -0.4462000       3.972800       1.603700    
 H   -4.126600      -1.080600      0.8870000    
 H    1.203900      -1.188200      -2.707200    
 H   -1.514900      -5.007400     -0.1448000    
 H  -5.7200000E-02  -5.301200      -1.076600    
 H    2.405700       2.833500      -3.240500    
 H    4.965100      0.3192000       1.199500    
 H   -1.147400     -0.6755000       3.145700    
 H   0.7780000      -3.063500       3.153500    


%chk=000126365-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126365

0 1
P 2.215143 2.218526 -0.563314
P 3.523041 -0.520274 0.279163
P 2.333066 0.217521 3.091457
F -3.780502 1.683021 1.545225
O -2.339745 1.714992 -1.329450
O -1.123921 2.417913 2.047081
O 0.677590 2.043571 -1.223549
O 2.929831 0.700509 -0.836515
O 2.986278 3.264505 -1.650173
O 2.299566 2.729560 0.955801
O 2.252488 -0.523327 1.493163
O 4.814482 0.283449 1.012584
O 3.736717 -1.888166 -0.453974
O 1.371959 1.567447 2.938869
O 1.355659 -0.743013 4.074852
O 3.884301 0.336195 3.482876
N -3.002557 -0.596915 -1.162883
N -3.415743 -2.362660 -2.577068
N -0.898659 -1.423665 -0.104823
N -0.241070 -3.629662 -0.965932
N -1.481099 -4.790655 -2.606645
C -1.411609 1.617536 0.880716
C -1.606264 2.539154 -0.341877
C -3.166536 0.727493 -0.582141
C -2.758511 0.853279 0.910785
C -0.356868 3.120899 -0.978571
C -1.956172 -1.513327 -0.960983
C -3.835569 -1.163368 -2.151874
C -2.238182 -2.594561 -1.836630
C -1.322234 -3.687449 -1.815069
C -0.087726 -2.525033 -0.178056
H -0.639376 0.852935 0.665494
H -2.236050 3.400715 -0.027319
H -4.230316 1.008636 -0.689598
H -2.729275 -0.101505 1.456255
H 0.054484 3.899688 -0.310854
H -0.574358 3.533097 -1.976149
H -0.463848 1.954695 2.633271
H -4.722984 -0.645947 -2.511736
H 0.790529 -2.517831 0.472547
H -2.269040 -4.847834 -3.248387
H -0.786680 -5.533705 -2.559551
H 3.941558 3.463136 -1.468452
H 4.749176 0.344870 2.044499
H 1.715302 2.200068 2.136929
H 1.799525 -1.531315 4.480906


