%chk=000001191.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001191

0 1
 P    3.835500      -1.536800      -1.232800    
 P    4.564400       1.291100     -0.8631000    
 P    2.871400       2.840200      0.9911000    
 O  -2.6100000E-02  -1.253000     -4.7200002E-02
 O   -1.926900      -1.111800       2.965500    
 O   3.0600000E-02  -3.512100       2.738900    
 O    2.504100      -2.311000     -0.7364000    
 O    3.595400      1.2000001E-03 -0.8007000    
 O    4.991200      -2.031300     -0.2144000    
 O   -6.140200      0.2925000      -2.437800    
 O    4.168200      -1.722900      -2.684700    
 O   -4.998000       2.872600       1.263300    
 O    3.599100       2.505900     -0.4127000    
 O    4.772500       1.542700      -2.446300    
 O    5.833800       1.175900     -7.1699999E-02
 O    1.952600       4.120300      0.6309000    
 O    1.799700       1.642300       1.157800    
 O    3.805200       3.031500       2.149700    
 N   -2.328900     -0.7438000     -0.2338000    
 N   -3.579000       1.150700      0.6785000    
 N   -3.673800      -1.267200      -1.946500    
 N   -5.559200       1.580500     -0.5804000    
 C   -1.390700      -1.781800       1.838100    
 C   2.4300000E-02  -2.253700       2.092300    
 C   -1.190000     -0.8134000      0.6793000    
 C   0.5777000      -2.337000      0.6792000    
 C    2.089200      -2.210200      0.6153000    
 C   -3.365700      0.1339000     -0.2069000    
 C   -2.560400      -1.573100      -1.306100    
 C   -4.174400     -0.1995000      -1.256700    
 C   -5.376200      0.5434000      -1.513300    
 C   -4.725300       1.933900      0.5118000    
 H   -2.056700      -2.614700       1.582000    
 H   0.5768000      -1.536600       2.711600    
 H  -0.9897000      0.2077000       1.023800    
 H   0.2701000      -3.267500      0.1849000    
 H    2.572300      -3.009800       1.185500    
 H    2.406000      -1.247100       1.028100    
 H   -1.946500      -1.747200       3.701100    
 H  -0.4146000      -3.403600       3.596400    
 H   -1.892700      -2.382300      -1.569700    
 H   -2.925100       1.326300       1.433700    
 H   -6.393000       2.148600     -0.7034000    
 H    5.412700      -2.904300     -0.3634000    
 H    5.403600      0.9751000      -2.937900    
 H    1.470600       4.577000       1.352900    
 H    1.281300       1.578800       1.988000    


%chk=000001191-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001191

0 1
P 3.248206 -2.001387 -1.282263
P 3.461004 1.011901 -0.455815
P 1.987663 2.371663 1.949718
O 0.539449 -1.347281 -0.028054
O -1.225862 0.469094 2.525999
O -0.579900 -2.563588 3.263402
O 2.650485 -3.158949 -0.186632
O 3.802182 -0.711654 -0.256074
O 4.619901 -2.877233 -1.756474
O -5.473730 0.452474 -3.143842
O 2.405948 -1.405504 -2.508357
O -4.998666 2.443806 1.081560
O 2.097398 1.219268 0.556162
O 2.929256 1.151986 -2.038810
O 4.668843 1.920767 0.024069
O 1.224155 1.341187 3.042903
O 3.569317 2.391257 2.542825
O 1.248297 3.702920 1.540155
N -1.552435 -0.419671 -0.712831
N -3.239007 1.098381 0.327192
N -2.631253 -0.852779 -2.681245
N -5.155742 1.407574 -1.027725
C -1.003343 -0.757031 1.725108
C 0.081007 -1.683053 2.308907
C -0.491938 -0.369952 0.311964
C 0.634701 -2.383801 1.038123
C 2.113872 -2.746289 1.137149
C -2.749384 0.283089 -0.678935
C -1.521852 -1.085096 -1.973339
C -3.414492 0.002683 -1.885353
C -4.727890 0.583013 -2.142327
C -4.510108 1.707710 0.183946
H -1.950000 -1.325049 1.660236
H 0.875502 -1.069059 2.781602
H -0.013115 0.625685 0.306889
H 0.011563 -3.257556 0.767503
H 2.267419 -3.639861 1.764041
H 2.703751 -1.895687 1.522871
H -1.750151 0.243202 3.336570
H 0.069505 -2.934453 3.910761
H -0.666886 -1.682467 -2.275571
H -2.706843 1.323455 1.175326
H -6.075183 1.846144 -1.144320
H 4.963600 -2.653909 -2.660799
H 2.549656 0.281061 -2.445761
H 0.220488 1.194437 2.900979
H 4.269814 2.448954 1.812368


