%chk=000129711.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129711

0 1
 P   -3.025800      0.6226000       1.093000    
 P   -2.195500      -1.976300     -1.2300000E-02
 P  -0.3889000      -1.579000      -2.310600    
 O   0.6134000       2.882000      0.5323000    
 O   -1.768600       1.420000      0.4591000    
 O   -2.539700     -0.9167000       1.156200    
 O   -3.042300       1.069500       2.647800    
 O   -4.328500      0.8272000      0.3757000    
 O    3.285400      -2.824000       1.303100    
 O   -1.096000      -1.201600     -0.9073000    
 O   -3.515500      -1.966000     -0.9453000    
 O   -1.770000      -3.334700      0.4616000    
 O   0.7069000     -0.4053000      -2.495600    
 O   0.5053000      -2.875500      -1.948300    
 O   -1.335900      -1.754200      -3.461000    
 N    2.307000       1.358600     -0.1178000    
 N    3.700200     -0.3894000     -0.3125000    
 N   0.8312000      0.4064000       1.567300    
 N    1.426800      -1.821100       2.264100    
 C    1.731200       2.683700     -0.3519000    
 C  -0.5059000       3.318000     -0.2555000    
 C    1.235700       2.895400      -1.778700    
 C  -0.2645000       2.767600      -1.648900    
 C   -1.798200       2.834500      0.3723000    
 C    1.875600      0.4010000      0.7334000    
 C    3.420400      0.8330000     -0.7327000    
 C    2.728400     -0.6599000      0.6093000    
 C    2.531900      -1.863100       1.400700    
 C   0.6760000     -0.7527000       2.302700    
 H    2.516900       3.401300     -8.9100003E-02
 H  -0.4898000       4.414600     -0.2727000    
 H    1.478700       3.918300      -2.092800    
 H    1.661700       2.217500      -2.523300    
 H  -0.8107000       3.316900      -2.421100    
 H  -0.5493000       1.713800      -1.719000    
 H   -2.663500       3.144600     -0.2217000    
 H   -1.895500       3.236500       1.385800    
 H    3.983600       1.385700      -1.472300    
 H   0.1917000       1.186300       1.673900    
 H  -0.1926000     -0.7109000       2.978700    
 H   -3.449700       1.928100       2.891100    
 H   -4.307900      -2.464500     -0.6524000    
 H    1.215900     -0.3568000      -3.332500    
 H   0.9788000      -3.342600      -2.669200    


%chk=000129711-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129711

0 1
P -2.321008 0.267180 1.178836
P -2.385489 -1.403288 -1.530329
P 0.006903 -3.570213 -2.094097
O 0.832821 3.500423 0.440468
O -1.162973 1.485465 0.779814
O -1.899896 -0.995015 0.108619
O -1.579677 -0.351556 2.588808
O -3.811336 0.789086 1.252959
O 1.304451 -2.809895 1.291481
O -0.936560 -1.970321 -2.112690
O -2.435330 0.228715 -2.139010
O -3.735923 -2.205988 -1.675720
O 1.488432 -2.854125 -2.330350
O -0.167836 -4.018542 -0.481809
O -0.543142 -4.585207 -3.161100
N 1.703731 1.471998 -0.513965
N 1.813727 -0.738560 -0.991945
N 1.631493 1.246306 1.986226
N 1.625220 -1.031893 2.784825
C 1.618261 2.964545 -0.664754
C -0.603188 3.691379 -0.022181
C 0.866903 3.386154 -1.940016
C -0.618796 3.272729 -1.510163
C -1.540191 2.907771 0.894172
C 1.692264 0.781904 0.693390
C 1.786509 0.494618 -1.513059
C 1.741191 -0.593363 0.401395
C 1.557752 -1.573632 1.465630
C 1.633364 0.272341 2.987843
H 2.634555 3.382781 -0.570328
H -0.805501 4.771136 0.110166
H 1.141347 4.432431 -2.160921
H 1.105962 2.779855 -2.827396
H -1.263547 3.939114 -2.105824
H -0.987235 2.238086 -1.618623
H -2.593079 3.060541 0.587183
H -1.422918 3.230837 1.945383
H 1.815800 0.716063 -2.574596
H 1.429905 2.236617 2.162328
H 1.634965 0.654215 4.013652
H -1.597862 -1.338956 2.689172
H -3.145838 0.354231 -2.819779
H 1.691327 -1.938898 -1.751089
H 0.468846 -3.588270 0.210999


