%chk=000122108.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122108

0 1
 P   0.8644000       3.196500     -0.7574000    
 P   -1.712500       2.122900      0.1764000    
 P   -3.336100     -4.1499998E-02   1.352700    
 O    1.989700      5.8600001E-02  0.9936000    
 O    4.889600     -0.8039000       1.374300    
 O    3.791900      -2.902000      4.0800001E-02
 O    2.360100       2.741300     -0.3403000    
 O  -0.1057000       2.169900      2.6699999E-02
 O   0.6361000       4.593100      2.6600000E-02
 O   0.6168000       3.268500      -2.236200    
 O   -1.974100      0.7372000      0.9649000    
 O   -1.640900      -1.479100      -2.946300    
 O   -2.231800       1.807400      -1.321500    
 O   -2.330600       3.331300      0.8157000    
 O   -2.810200      -1.263900       2.270100    
 O   -4.049000      0.9465000       2.414400    
 O   -4.182800     -0.4424000      0.1807000    
 N   0.7938000      -1.914900      0.4412000    
 N   0.1762000      -1.628300     -0.7148000    
 N   -1.203800      -3.014500      0.2595000    
 N   -3.079700      -2.910000      -1.907800    
 C    4.161200     -0.4906000      0.1871000    
 C    3.210900      -1.626300     -0.1372000    
 C    3.204100      0.6589000      0.4864000    
 C    2.085800      -1.372000      0.8544000    
 C    2.855200       1.477500     -0.7487000    
 C  -8.1600003E-02  -2.757300      0.9938000    
 C   -1.010200      -2.286000     -0.8153000    
 C   -1.886700      -2.176800      -1.933700    
 H    4.887500     -0.2927000     -0.6062000    
 H    2.860800      -1.538400      -1.172600    
 H    3.589100       1.312000       1.278000    
 H    2.301500      -1.802900       1.839700    
 H    2.116500      0.9682000      -1.377200    
 H    3.748000       1.672200      -1.350700    
 H    5.455800     -3.9700001E-02   1.577200    
 H    4.574100      -2.948400     -0.5349000    
 H   8.3600000E-02  -3.208900       1.963700    
 H  -0.1644000       5.123500     -0.1738000    
 H   -3.332300      -3.499200      -1.120800    
 H   -3.732500      -2.870800      -2.683500    
 H   -3.196300       1.809700      -1.499800    
 H   -3.448300      -1.951200       2.557300    
 H   -4.946400      0.7239000       2.742000    


%chk=000122108-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122108

0 1
P 0.470003 2.889806 -0.226487
P -2.588757 2.800042 0.164632
P -3.965174 0.154330 0.993854
O 2.932325 -0.580903 1.504726
O 5.659081 -0.883739 0.186471
O 4.480935 -3.088609 -0.343786
O 1.564336 1.806113 0.559910
O -1.041896 1.995293 0.003900
O 0.343484 4.153047 0.886051
O 0.852374 3.175332 -1.735313
O -3.362456 1.804690 1.342551
O -1.322954 -4.159795 -1.968668
O -3.432803 2.521221 -1.258520
O -2.353014 4.309973 0.604020
O -3.120484 -0.976180 1.754634
O -5.480552 0.243107 1.753637
O -3.953723 0.075391 -0.635446
N 1.213267 -1.922568 0.557583
N 0.698636 -2.584202 -0.564018
N -0.954273 -1.747453 0.743292
N -2.794682 -2.383735 -1.601004
C 4.359066 -0.588439 -0.419017
C 3.585289 -1.962195 -0.410062
C 3.500821 0.338492 0.473812
C 2.686856 -1.854978 0.866888
C 2.436376 1.048952 -0.368377
C 0.218986 -1.420144 1.335645
C -0.644417 -2.451429 -0.423880
C -1.622770 -3.069527 -1.400988
H 4.478723 -0.199595 -1.447938
H 2.964646 -2.089101 -1.311312
H 4.090737 1.073325 1.043805
H 2.920082 -2.661958 1.579479
H 1.826802 0.337663 -0.959316
H 2.927639 1.743957 -1.076694
H 6.334681 -0.205279 -0.052053
H 5.343039 -2.745756 0.030751
H 0.354451 -0.841722 2.243810
H -0.608120 4.527171 0.939858
H -3.064109 -1.456112 -1.219374
H -3.463363 -2.827103 -2.234295
H -3.745483 1.517578 -1.293976
H -1.959730 -1.457973 1.173548
H -5.967075 1.100410 1.646165


