%chk=000125136.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125136

0 1
 P    3.010300      -3.546800      0.7699000    
 O    1.166100     -0.7568000      -1.977800    
 O    2.834700      -1.936600      0.9492000    
 O    3.030600      0.7458000      7.2800003E-02
 O    2.913000      -3.798700     -0.8337000    
 O    1.620400      -4.150800       1.341000    
 O    4.237900      -4.110400       1.424400    
 O  -0.2504000       2.896300     -0.8561000    
 O    2.256900       2.658400       1.105400    
 O   -4.740300     -0.9355000      0.7853000    
 N  -0.4327000      0.5925000     -0.9303000    
 N   -2.338300       2.037400     -0.5943000    
 N   -4.423100       1.079700     -0.3369000    
 C    1.819700      -1.346700      0.1696000    
 C    1.735800      0.1614000      0.1719000    
 C    2.080700      -1.612400      -1.297000    
 C   0.9782000      0.4119000      -1.139800    
 C    1.933600      -3.090300      -1.595900    
 C   -1.275100     -0.5105000     -0.8580000    
 C  -0.9734000       1.900200     -0.7959000    
 C    3.153700       2.010300      0.5836000    
 C    4.577800       2.482700      0.4000000    
 C   -2.590300     -0.4070000     -0.6655000    
 C   -3.072000      0.9761000     -0.5358000    
 C    4.781900       3.901300      0.9258000    
 C    6.224200       4.353200      0.7655000    
 C   -5.174700      0.1122000      0.3142000    
 C   -6.638700      0.5112000      0.3784000    
 C   -7.496300     -0.5316000       1.089300    
 C   -8.950200     -9.6299998E-02   1.170700    
 H   0.8561000      -1.759900      0.4890000    
 H    1.217000      0.5187000       1.069100    
 H    3.103800      -1.312600      -1.565000    
 H    1.385200       1.271300      -1.684500    
 H    2.103400      -3.289100      -2.658500    
 H   0.9340000      -3.464900      -1.351100    
 H  -0.8458000      -1.493500      -1.004800    
 H    5.236900       1.790100      0.9354000    
 H    4.815100       2.447400     -0.6692000    
 H    1.542300      -5.120300       1.468000    
 H   -3.207800      -1.287900     -0.7465000    
 H    4.504100       3.951600       1.985500    
 H    4.121900       4.596000      0.3925000    
 H   -4.839700       1.998800     -0.4612000    
 H    6.347100       5.371600       1.147200    
 H    6.522300       4.346900     -0.2878000    
 H    6.904500       3.698300       1.319400    
 H   -7.000400      0.6589000     -0.6462000    
 H   -6.709100       1.471700      0.9032000    
 H   -7.114100     -0.7031000       2.102700    
 H   -7.433300      -1.490200      0.5606000    
 H   -9.048600      0.8414000       1.727000    
 H   -9.546100     -0.8586000       1.682200    
 H   -9.372100      5.0700001E-02  0.1714000    


%chk=000125136-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000125136

0 1
P 3.955453 -3.064093 0.814902
O 0.965709 -1.129237 -1.894231
O 3.435301 -1.385657 0.828930
O 2.822918 1.078263 -0.414327
O 3.586034 -3.608807 -0.789906
O 2.694927 -3.854514 1.702027
O 5.437418 -3.290337 1.290211
O -0.399035 2.493551 -0.458705
O 3.035958 1.829873 1.789746
O -5.655744 -1.352469 0.123175
N -0.719384 0.203620 -0.817624
N -2.564875 1.615244 -0.133032
N -4.674999 0.777558 0.228174
C 2.141189 -1.218525 0.147221
C 1.689589 0.244756 0.008032
C 2.212682 -1.678062 -1.324456
C 0.712552 0.161695 -1.209929
C 2.295357 -3.201820 -1.435259
C -1.535852 -0.904205 -0.821838
C -1.218502 1.532180 -0.456420
C 3.440783 1.846442 0.613530
C 4.594624 2.638662 0.036992
C -2.872256 -0.802989 -0.471005
C -3.341945 0.513071 -0.131263
C 5.295126 3.528649 1.083253
C 6.466687 4.321734 0.468809
C -5.755791 -0.115054 0.356889
C -7.054550 0.539981 0.831894
C -8.307186 -0.091043 0.179408
C -9.614162 0.451745 0.792347
H 1.359241 -1.796254 0.682558
H 1.231555 0.666653 0.915325
H 3.095693 -1.217102 -1.808727
H 0.907707 1.011490 -1.885192
H 2.390797 -3.560594 -2.470515
H 1.449747 -3.702723 -0.928550
H -1.074293 -1.840886 -1.140473
H 5.309322 1.921529 -0.413060
H 4.206852 3.245178 -0.804851
H 2.932799 -4.105712 2.630516
H -3.542937 -1.659864 -0.468075
H 5.657701 2.895939 1.914554
H 4.555509 4.221882 1.525187
H -4.835008 1.771248 0.427573
H 6.957750 4.953552 1.230521
H 6.120267 4.985620 -0.345768
H 7.234224 3.644586 0.048444
H -7.035718 1.633187 0.655501
H -7.112959 0.396987 1.931086
H -8.248464 -1.187572 0.301171
H -8.289997 0.105432 -0.910011
H -9.668749 0.229746 1.874886
H -10.495954 -0.007142 0.310403
H -9.696413 1.548109 0.668352


