%chk=000124818.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124818

0 1
 P    3.791300      -1.040800      0.1764000    
 P    3.514400       1.712500     -0.8256000    
 P   0.9431000       2.966500      0.5922000    
 O    2.629400      -2.047700      0.6810000    
 O   -1.602700      -4.363600      0.4836000    
 O   0.1972000      -2.739300       1.845000    
 O    3.009900      0.3323000     -0.1604000    
 O    4.412900       2.387700      0.3348000    
 O    4.206000      -1.604900      -1.282100    
 O    4.189200       1.577600      -2.157600    
 O    4.939900     -0.8802000       1.129400    
 O   0.4143000       1.474400      0.9159000    
 O  -0.3519000       3.699400     -3.6800001E-02
 O   -2.730500      0.1201000       2.422400    
 O    1.593600       3.682100       1.737800    
 N   -2.541900     -0.8089000      -2.186300    
 N   -1.885000      -1.534600      0.4180000    
 N   -3.662100       1.138900      -1.299200    
 N   -3.758700       1.606900       1.008800    
 N   -4.758100       3.027100     -0.5778000    
 C  -0.7173000      -3.525900     -0.2459000    
 C   0.5521000      -3.260800      0.5624000    
 C   -1.499100      -2.290400     -0.5665000    
 C   -1.777200      -2.018900      -2.032400    
 C    1.493000      -2.280700     -0.1329000    
 C   -2.939000     -1.9099999E-02  -1.132300    
 C   -2.602100     -0.4016000      0.1177000    
 C    2.018100       2.724100     -0.8406000    
 C   -3.033200      0.4587000       1.280300    
 C   -4.045500       1.909100     -0.2297000    
 H  -0.4596000      -4.044600      -1.175300    
 H    1.080400      -4.201800      0.7571000    
 H   -2.330100      -2.866600      -2.449100    
 H  -0.8229000      -1.928000      -2.560700    
 H    1.811100      -2.680600      -1.100800    
 H   0.9999000      -1.317100     -0.2933000    
 H   -2.805700     -0.5018000      -3.116000    
 H    1.383900       2.300500      -1.628100    
 H    2.314300       3.721300      -1.184400    
 H   -1.850600      -3.906500       1.304900    
 H  -0.2096000      -3.460700       2.353900    
 H   -3.898600       1.398100      -2.250300    
 H    5.305200       2.023200      0.5170000    
 H    4.808300      -2.377000      -1.338200    
 H  -0.1713000       1.335200       1.690300    
 H   -1.082000       3.969400      0.5601000    
 H   -4.967600       3.240700      -1.546800    
 H   -5.095800       3.674600      0.1260000    


%chk=000124818-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124818

0 1
P 4.334303 -1.054262 -0.480627
P 4.148311 2.034984 0.019352
P 1.268078 1.455772 1.217980
O 3.069995 -2.104409 -0.093843
O -1.282830 -3.708075 0.998013
O 0.586395 -1.977392 1.692109
O 3.635497 0.491647 -0.756021
O 4.986053 1.539477 1.411480
O 4.726746 -1.622014 -2.049376
O 4.907251 2.959439 -1.017176
O 5.535934 -0.978477 0.565068
O 0.461105 1.003312 -0.199365
O 0.216814 2.447798 2.105069
O -2.114075 2.039090 1.060819
O 1.908373 0.202094 1.998506
N -3.740525 -1.529625 -1.678833
N -1.575879 -0.563061 -0.221758
N -4.653958 0.691373 -1.850366
N -3.744090 2.492118 -0.537591
N -5.469675 2.908330 -2.062497
C -0.636314 -2.942653 -0.102332
C 0.787659 -2.605146 0.404437
C -1.680443 -1.865621 -0.387833
C -3.065481 -2.447468 -0.734640
C 1.678370 -1.884181 -0.611130
C -3.703002 -0.195502 -1.343884
C -2.705928 0.269136 -0.476577
C 2.540604 2.699388 0.670064
C -2.808052 1.630851 0.078431
C -4.583156 2.045143 -1.457336
H -0.576125 -3.635878 -0.961949
H 1.266055 -3.597456 0.565985
H -3.659123 -2.559418 0.194069
H -2.965304 -3.446028 -1.185082
H 1.611656 -2.378607 -1.598950
H 1.482785 -0.802875 -0.705418
H -4.139769 -1.869593 -2.553467
H 2.084171 3.326221 -0.111030
H 2.781505 3.324500 1.547026
H -0.957220 -3.232352 1.823116
H 1.190933 -1.157395 1.885416
H -5.466913 0.331890 -2.356034
H 5.409649 0.614450 1.359444
H 5.493565 -1.164327 -2.481043
H -0.363942 0.304042 -0.108774
H -0.764189 2.341199 1.829545
H -6.000745 2.673848 -2.897473
H -5.445671 3.874011 -1.739622


