%chk=000038849.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038849

0 1
 P    5.726700     -0.6207000     -0.2095000    
 O    4.901300      0.7133000     -0.6510000    
 O    5.049000      -1.873900     -0.7093000    
 O   -2.709100       1.668700      0.6740000    
 O   -1.579400      6.0000001E-03 -0.4749000    
 O   -7.853800      -1.855800      0.4733000    
 O   -8.210100     -0.7362000      -1.506200    
 N    5.918600     -0.5194000       1.437000    
 N    7.248600     -0.3842000     -0.8332000    
 N  -0.4304000       1.783800      0.5260000    
 C    6.433500      -1.708200       2.104100    
 C    4.996300      -1.301500       2.250400    
 C    8.069100      -1.574100      -1.019500    
 C    7.472200     -0.8554000      -2.193900    
 C    3.597000      0.9762000     -0.3647000    
 C    3.260200       2.109900      0.3749000    
 C    2.597400      0.1108000     -0.8091000    
 C    1.923600       2.378100      0.6701000    
 C    1.260800      0.3791000     -0.5138000    
 C   0.9239000       1.512700      0.2257000    
 C   -1.544300       1.046200      0.1725000    
 C   -3.877700       1.031900      0.3890000    
 C   -4.575100       1.343700     -0.7781000    
 C   -4.378900      6.9100000E-02   1.264900    
 C   -6.275000     -0.2704000     -0.1933000    
 C   -5.773700      0.6925000      -1.069300    
 C   -5.577600     -0.5820000      0.9737000    
 C   -7.525200     -0.9486000     -0.4968000    
 C   -9.067800      -2.591400      0.2868000    
 H    7.100700      -1.526100       2.935300    
 H    6.654600      -2.578200       1.502600    
 H    4.238500      -1.884200       1.746700    
 H    4.690800     -0.8421000       3.180600    
 H    9.126100      -1.447200     -0.8296000    
 H    7.653500      -2.532700     -0.7433000    
 H    6.643200      -1.311800      -2.715800    
 H    8.125800     -0.2419000      -2.798900    
 H    4.035000       2.786600      0.7246000    
 H    2.840200     -0.7654000      -1.402200    
 H    1.674600       3.264600       1.247900    
 H   0.5421000     -0.3332000     -0.8947000    
 H  -0.6028000       2.626300       1.069100    
 H   -4.190300       2.093400      -1.464100    
 H   -3.840400     -0.1774000       2.176100    
 H   -6.301300      0.9506000      -1.983700    
 H   -5.929600      -1.324100       1.684800    
 H   -9.921400      -1.907900      0.2545000    
 H   -9.012300      -3.184100     -0.6310000    
 H   -9.189800      -3.268000       1.136600    


%chk=000038849-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038849

0 1
P 6.118531 -1.134213 0.197826
O 5.178859 0.125369 -0.626241
O 5.415813 -2.568163 0.242939
O -2.614609 1.083546 -0.107900
O -1.431031 -0.993830 -0.169014
O -8.390595 -1.754564 0.077056
O -9.053745 0.476947 0.189881
N 6.510630 -0.347343 1.749093
N 7.647036 -1.056903 -0.635268
N -0.380253 1.126429 -0.234560
C 6.839238 -1.273979 2.915228
C 5.513178 -0.543843 2.886145
C 7.751795 -0.994629 -2.137109
C 8.186066 0.191577 -1.285569
C 3.778794 0.298782 -0.478643
C 3.309365 1.630737 -0.442671
C 2.870697 -0.784735 -0.429324
C 1.926096 1.877543 -0.366602
C 1.485330 -0.536284 -0.340097
C 1.004527 0.798477 -0.311988
C -1.448732 0.257050 -0.172228
C -3.944536 0.592784 -0.053010
C -4.914634 1.621258 0.029189
C -4.321537 -0.772453 -0.080765
C -6.679374 -0.076150 0.056038
C -6.276581 1.285595 0.083505
C -5.693603 -1.091420 -0.025801
C -8.134895 -0.377781 0.114945
C -9.820317 -2.134238 0.130194
H 7.655816 -0.906340 3.542327
H 6.821301 -2.354555 2.728875
H 4.614981 -1.142252 2.690787
H 5.367084 0.353922 3.492891
H 8.499757 -1.669834 -2.561996
H 6.825853 -0.885305 -2.713856
H 7.545175 1.079377 -1.292702
H 9.248515 0.365907 -1.092159
H 4.029058 2.453569 -0.478884
H 3.248327 -1.811589 -0.456936
H 1.564030 2.913075 -0.345744
H 0.779823 -1.368469 -0.300827
H -0.628540 2.118105 -0.225693
H -4.583085 2.663344 0.048241
H -3.564990 -1.554668 -0.141480
H -7.045880 2.061558 0.147079
H -6.008484 -2.138161 -0.046535
H -10.275683 -1.780208 1.070531
H -10.365722 -1.693628 -0.721403
H -9.821552 -3.232013 0.077533


