%chk=000001459.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001459

0 1
 P    3.713900     -0.3026000      -1.395900    
 P    3.764800      -1.173300       1.413700    
 F   0.3730000       2.971900       1.028300    
 O  -0.3784000      0.4135000     -0.1461000    
 O    2.157300      0.1334000      -1.346300    
 O   -3.710800      0.3954000       2.256100    
 O    4.196000     -0.2672000      0.1470000    
 O    4.469600      0.9697000      -2.049600    
 O    3.978600      -1.605300      -2.093300    
 O   -5.870400      -2.139700     -0.9305000    
 O    4.770400     -0.6781000       2.577900    
 O    4.323300      -2.640800       1.030300    
 O    2.306200      -1.112300       1.759500    
 N   -2.681700      0.1304000      0.1751000    
 N   -4.784400     -0.8673000      0.6682000    
 C   0.2774000       1.507200     -0.8113000    
 C  -0.2591000       2.767000     -0.1589000    
 C   -1.540700      0.9236000      0.5268000    
 C   -1.687900       2.382600      0.1238000    
 C    1.781400       1.346400     -0.7131000    
 C   -3.718600     -7.5999998E-02   1.116900    
 C   -2.771100     -0.4372000      -1.091800    
 C   -3.793400      -1.189200      -1.505100    
 C   -4.915500      -1.452300     -0.5817000    
 H  -3.5999998E-02   1.456400      -1.861600    
 H  -0.1460000       3.665800     -0.7698000    
 H   -1.348200      0.8470000       1.603600    
 H   -2.151300       2.977700      0.9160000    
 H   -2.290800       2.488800     -0.7861000    
 H    2.095600       1.301900      0.3340000    
 H    2.287700       2.184600      -1.201500    
 H   -1.961400     -0.2342000      -1.783500    
 H   -5.539600      -1.027900       1.329000    
 H   -3.830800      -1.608400      -2.503100    
 H    4.446200       1.086200      -3.023200    
 H    4.651200      -1.024800       3.487700    
 H    4.113300      -3.397300       1.618300    


%chk=000001459-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000001459

0 1
P 4.197881 0.034577 -1.064227
P 2.508017 -1.029755 1.396455
F 0.252977 3.616829 0.144426
O -0.094555 0.498570 -0.528161
O 2.647527 0.615449 -1.518976
O -2.561744 0.152178 2.583072
O 3.890075 -0.986175 0.293279
O 4.831369 1.482171 -0.386184
O 5.013221 -0.684175 -2.201640
O -5.129460 -3.064504 0.356868
O 2.944084 -2.411785 2.267245
O 1.226539 -1.539768 0.427375
O 2.313046 0.289588 2.245214
N -2.284040 -0.080125 0.250616
N -3.809728 -1.457997 1.424875
C 0.524798 1.636139 -1.283248
C -0.354211 2.863318 -0.960571
C -1.277711 0.983581 0.248999
C -1.685567 2.282532 -0.478639
C 1.993522 1.800668 -0.899374
C -2.865096 -0.431471 1.511217
C -2.647609 -0.729167 -0.933436
C -3.585461 -1.726180 -0.970238
C -4.251575 -2.165216 0.258599
H 0.458167 1.375606 -2.355631
H -0.435712 3.567756 -1.804180
H -0.991683 1.163154 1.298940
H -2.210394 2.981891 0.189925
H -2.338725 2.058211 -1.341416
H 2.133078 1.818957 0.195944
H 2.415781 2.719874 -1.340947
H -2.101326 -0.411785 -1.825158
H -4.241717 -1.732960 2.313643
H -3.844296 -2.230099 -1.901526
H 5.722748 1.420345 0.040353
H 3.236249 -3.187735 1.723938
H 0.691330 -0.776896 -0.017629


