%chk=000163614.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163614

0 1
 P   -4.633900     -0.1217000     -0.6264000    
 P   -2.791900       2.141100      -1.006900    
 O   0.7311000      0.6170000      0.9359000    
 O    1.375500       2.135000       3.599300    
 O    2.414200       3.006500      0.2593000    
 O   -3.682800      -1.194400      0.1261000    
 O   -1.752900       1.573200      9.5399998E-02
 O   -3.609800      0.8193000      -1.450700    
 O   -5.366400     -0.9781000      -1.787200    
 O    4.655300     -0.5413000       1.080100    
 O   -1.863600       2.444300      -2.296500    
 O   -5.571300      0.6298000      0.2738000    
 O   -3.652000       3.287500     -0.5614000    
 N    2.823600      0.2749000     -6.2799998E-02
 N    4.683200     -0.7955000      -1.175200    
 N    4.706600      -1.051200      -3.486400    
 C   -1.560600      -2.280700      0.2793000    
 C    1.182500       2.560100       2.252100    
 C    2.408500       2.207100       1.436300    
 C   8.0100000E-02   1.701600       1.629400    
 C  -0.4898000      -3.056400     -0.4997000    
 C   -2.006500      -3.063000       1.522000    
 C    2.148300      0.7448000       1.109700    
 C   0.6937000      -3.431200      0.3896000    
 C  -0.8205000      -3.437600       2.407800    
 C   0.2456000      -4.200900       1.628100    
 C   -2.756500      -1.964400     -0.6170000    
 C  -0.7744000       2.454000      0.6191000    
 C    2.220500      0.4543000      -1.300400    
 C    4.089100     -0.3666000     -5.0000002E-04
 C    2.775900      5.0099999E-02  -2.441300    
 C    4.099000     -0.6176000      -2.331000    
 H   -1.130800      -1.331700      0.6244000    
 H   0.9436000       3.628100       2.259900    
 H    3.359600       2.342700       1.960500    
 H  -0.5668000       1.244100       2.387100    
 H  -0.9252000      -3.969500     -0.9253000    
 H  -0.1303000      -2.452800      -1.341600    
 H   -2.713600      -2.472000       2.115600    
 H   -2.532600      -3.977400       1.218900    
 H    2.420900      0.1164000       1.966800    
 H    1.407600      -4.034800     -0.1821000    
 H    1.221200      -2.520000      0.6974000    
 H  -0.3803000      -2.526300       2.831600    
 H   -1.167400      -4.046400       3.250300    
 H  -0.1521000      -5.177700       1.326500    
 H    1.108900      -4.393200       2.275100    
 H   -2.425600      -1.413100      -1.503300    
 H   -3.256000      -2.879600     -0.9522000    
 H   -1.276500       3.301600       1.096500    
 H  -0.1697000       2.823800     -0.2142000    
 H   0.5618000       2.343300       4.089500    
 H    2.531000       3.931500      0.5356000    
 H    1.261500      0.9583000      -1.330100    
 H    2.311800      0.1930000      -3.408000    
 H   -6.093100     -0.5611000      -2.297100    
 H   -1.294500       1.727500      -2.649300    
 H    5.609500      -1.512500      -3.458200    
 H    4.278400     -0.9284000      -4.398100    


%chk=000163614-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163614

0 1
P -2.622120 -0.401123 0.563234
P -2.641185 2.352323 -0.879353
O 2.089878 1.763699 -1.579405
O 1.392257 0.031405 0.898960
O 2.213060 3.572749 0.751003
O -3.815890 -1.578882 0.350570
O -1.291064 2.794792 -1.782280
O -2.848850 0.611375 -0.882602
O -3.245001 0.538465 1.814888
O 4.581469 4.171281 0.046238
O -3.841685 2.816153 -1.980007
O -1.124829 -0.925474 0.658574
O -2.706042 2.853874 0.643890
N 4.420227 2.132703 -1.155482
N 6.200405 3.732366 -1.554387
N 7.849064 3.337317 -3.134842
C -3.002834 -3.824946 1.163128
C 1.172397 1.443245 0.647589
C 2.535879 2.164340 0.751347
C 0.789494 1.715628 -0.843631
C -2.503037 -5.210733 0.668519
C -4.164737 -3.990520 2.173593
C 3.167461 1.614970 -0.558483
C -2.085806 -6.106991 1.859475
C -3.745414 -4.882563 3.366101
C -3.235548 -6.261483 2.883482
C -3.395973 -2.975642 -0.049239
C 0.039330 3.041377 -1.081537
C 4.959844 1.311847 -2.138073
C 5.059414 3.408006 -0.852596
C 6.098028 1.646257 -2.836768
C 6.708771 2.912723 -2.499330
H -2.152725 -3.324523 1.673240
H 0.447574 1.894909 1.351834
H 3.109915 1.842406 1.640417
H 0.207803 0.868046 -1.252819
H -3.314846 -5.713309 0.100832
H -1.648568 -5.083873 -0.025775
H -4.501313 -2.998912 2.529339
H -5.028285 -4.458834 1.654205
H 3.325395 0.531672 -0.380466
H -1.766327 -7.099738 1.487946
H -1.207274 -5.653374 2.362164
H -2.942053 -4.374001 3.937820
H -4.598784 -5.009860 4.059408
H -4.073851 -6.814539 2.410710
H -2.897104 -6.868379 3.745269
H -2.569006 -2.907487 -0.780786
H -4.306793 -3.353659 -0.544326
H -0.138946 3.616038 -0.159510
H 0.576605 3.654988 -1.816909
H 0.505154 -0.440575 0.876396
H 3.094538 4.056276 0.576187
H 4.414011 0.384781 -2.330631
H 6.499816 0.980161 -3.602278
H -3.087923 1.546395 1.667165
H -4.688734 2.304659 -1.913420
H 8.238499 4.238352 -2.859875
H 8.297358 2.787637 -3.862613


