%chk=000000823.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000823

1 1
 P  -0.4805000       2.174100      0.1151000    
 O   0.7971000       1.418900      0.7567000    
 O   -1.430700      0.9875000     -0.4438000    
 O   9.4099998E-02   2.850800      -1.238200    
 O   -3.912800     -0.2460000     -0.9620000    
 O   -1.165100       3.139200       1.040100    
 O   -4.339200      -2.814600     -8.8000000E-03
 N    3.472800      -1.056300     -4.3099999E-02
 C    2.670000     -8.1600003E-02  0.8063000    
 C    2.577300      -2.207400     -0.4780000    
 C    4.637300      -1.599700      0.7724000    
 C    4.006900     -0.3367000      -1.273100    
 C    1.529800      0.4803000     -1.9700000E-02
 C   -2.880400     -0.9248000     -0.2430000    
 C   -2.034000      0.1092000      0.4907000    
 C   -3.542700      -1.893000      0.7284000    
 H    3.342700      0.7139000       1.148800    
 H    2.299800     -0.6139000       1.690700    
 H    3.213300      -2.979900     -0.9225000    
 H    1.863600      -1.868300      -1.232600    
 H    2.066200      -2.607600      0.4026000    
 H    5.270800     -0.7594000       1.071500    
 H    5.202800      -2.301500      0.1523000    
 H    4.233700      -2.108700       1.652800    
 H    4.482900      0.5963000     -0.9573000    
 H    3.200000     -0.1545000      -1.987000    
 H    4.747300     -0.9881000      -1.749100    
 H   0.8298000     -0.2954000     -0.3345000    
 H    1.882700       1.017300     -0.9018000    
 H   -2.285800      -1.460700     -0.9903000    
 H   -2.657100      0.7084000       1.163700    
 H   -1.254500     -0.3838000       1.080300    
 H   -2.797100      -2.459000       1.294600    
 H   -4.202200      -1.374900       1.432400    
 H   0.5894000       3.694900      -1.172500    
 H   -4.453100      0.2451000     -0.3196000    
 H   -4.992400      -2.298200     -0.5112000    


%chk=000000823-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000000823

1 1
P -0.589699 1.775647 1.430123
O 0.817467 0.815473 1.117911
O -1.508310 1.749114 -0.038967
O 0.141519 3.310566 1.298182
O -0.961763 -0.717062 -1.478199
O -1.338408 1.308050 2.737484
O -2.430486 -3.085241 -0.760010
N 2.912107 -1.200203 0.089486
C 2.979601 0.348275 0.119705
C 2.259087 -1.745663 1.366444
C 4.348020 -1.722329 0.015708
C 2.138231 -1.692785 -1.133106
C 1.661962 1.095690 -0.063631
C -1.969160 -0.694904 -0.381931
C -2.562597 0.706244 -0.180181
C -3.046893 -1.767649 -0.643798
H 3.666820 0.642820 -0.693903
H 3.433418 0.620407 1.087514
H 2.174287 -2.839312 1.272994
H 1.276156 -1.273906 1.488911
H 2.895657 -1.487178 2.226628
H 4.794656 -1.426372 -0.945902
H 4.332821 -2.819706 0.097496
H 4.930302 -1.297089 0.847507
H 2.588192 -1.253306 -2.037966
H 1.077676 -1.402034 -1.062609
H 2.224635 -2.789912 -1.174409
H 1.111606 0.808100 -0.977348
H 1.897251 2.175715 -0.107259
H -1.388017 -1.002924 0.505190
H -3.132292 1.048445 -1.062241
H -3.221555 0.715687 0.708192
H -3.733813 -1.842345 0.215559
H -3.638391 -1.508521 -1.550061
H -0.421413 4.103799 1.483121
H -1.338018 -0.272286 -2.281594
H -1.797955 -3.061404 -1.523741


