%chk=000093023.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093023

0 1
 P   -3.756500      -1.991200      0.4495000    
 O   -1.048900       1.826500     -0.9899000    
 O   -3.655400     -0.4952000     -0.1500000    
 O   -3.005500       3.840900     -0.7582000    
 O   -5.315600      -2.377700      0.2625000    
 O   -3.623000      -1.743800       2.041900    
 O   -2.778400      -2.974900     -0.1233000    
 O    4.834600      0.2989000       1.947800    
 N   0.8283000      0.6719000     -0.1180000    
 N    2.503300     -0.7052000      -1.220700    
 N    2.064000       1.266100       1.662000    
 N    4.597200     -0.8460000     -5.3300001E-02
 N    4.232700      -1.964500      -2.095900    
 C   -2.436300      0.2031000     -7.9999998E-04
 C  -0.3203000      0.5850000      -1.020900    
 C   -1.296400     -0.5321000     -0.6704000    
 C   -2.432500       1.525900     -0.7481000    
 C   -3.075300       2.662800      2.5500000E-02
 C    2.043400      8.7499999E-02 -0.2494000    
 C   0.8905000       1.380200       1.063100    
 C    2.786600      0.4533000      0.8346000    
 C    4.149200     -1.7700000E-02  0.9831000    
 C    3.814100      -1.154000      -1.071200    
 H   -2.218600      0.3530000       1.063400    
 H   8.1799999E-02  0.4571000      -2.032000    
 H  -0.8506000      -1.305700     -3.7500001E-02
 H   -1.642400      -1.018300      -1.591300    
 H   -2.921500       1.431000      -1.726500    
 H   -2.538700       2.853100      0.9608000    
 H   -4.124600       2.445300      0.2468000    
 H   5.4099999E-02   1.953900       1.438700    
 H    1.952600     -0.9827000      -2.026600    
 H   -3.421700       4.553000     -0.2431000    
 H   -5.612900      -3.280700      0.5045000    
 H   -3.559300      -2.519400       2.638900    
 H    5.167500      -2.357800      -2.105400    
 H    3.621900      -2.194800      -2.871900    


%chk=000093023-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000093023

0 1
P -3.314935 -2.343082 0.229338
O -1.408611 2.101801 -1.374844
O -3.389379 -0.710733 -0.304966
O -3.238601 3.639810 0.422545
O -4.953275 -2.806698 0.097161
O -3.164555 -2.077129 1.909263
O -2.237229 -3.283817 -0.464534
O 4.683321 0.829383 1.801332
N 0.718578 1.228350 -0.671116
N 2.057104 -0.892165 -0.943397
N 2.102217 2.272561 0.829750
N 4.029904 -0.992910 0.465287
N 3.473588 -2.789799 -0.935810
C -2.129902 0.072063 -0.267259
C -0.418756 1.060785 -1.628074
C -1.169351 -0.271342 -1.426942
C -2.501805 1.552696 -0.503243
C -2.653942 2.349058 0.788437
C 1.787690 0.371224 -0.423219
C 0.981388 2.388557 0.108400
C 2.627863 1.005530 0.510433
C 3.852615 0.336216 0.994930
C 3.215589 -1.526836 -0.424786
H -1.643008 -0.073802 0.716062
H -0.050431 1.216645 -2.657360
H -0.541967 -1.145758 -1.199445
H -1.765450 -0.480041 -2.332275
H -3.439520 1.620978 -1.083712
H -1.667832 2.464948 1.284396
H -3.330494 1.775585 1.459787
H 0.326578 3.252968 0.060612
H 1.575996 -1.266212 -1.762087
H -3.313669 4.212951 1.225777
H -5.202429 -3.231813 -0.762768
H -2.994168 -2.878847 2.465258
H 4.320260 -3.236976 -0.590629
H 2.764017 -3.357347 -1.393599


