%chk=000170946.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170946

0 1
 P   -7.124800      0.2771000      2.0600000E-02
 O   -5.602100      0.6387000      0.4275000    
 O   -7.086000      0.3309000      -1.595100    
 O   -7.242700      -1.304300      0.3373000    
 O   -8.174800       1.139200      0.6584000    
 C    3.048000     -0.9119000     -0.2789000    
 C    4.375400     -0.4334000      0.3147000    
 C    1.827100     -0.2094000      0.3238000    
 C    5.599500      -1.078900     -0.3430000    
 C   0.4974000     -0.7040000     -0.2520000    
 C    6.956800     -0.7031000      0.2644000    
 C  -0.6850000      4.9300000E-02  0.3634000    
 C    7.347100      0.7833000      0.1634000    
 C   -2.044600     -0.4130000     -0.1683000    
 C   -3.220200      0.3877000      0.3892000    
 C    7.352900       1.286800      -1.280500    
 C    8.727100      0.9988000      0.7913000    
 C   -4.551100     -0.1338000     -0.1362000    
 H    3.056400     -0.7443000      -1.363000    
 H    2.954900      -1.994100     -0.1261000    
 H    4.438000      0.6555000      0.2059000    
 H    4.387600     -0.6472000       1.390300    
 H    1.916800      0.8707000      0.1529000    
 H    1.828000     -0.3593000       1.410600    
 H    5.596700     -0.8614000      -1.417200    
 H    5.494200      -2.168800     -0.2619000    
 H   0.4937000     -0.5670000      -1.339900    
 H   0.3903000      -1.778100     -5.9799999E-02
 H    7.726900      -1.310100     -0.2295000    
 H    6.960800      -1.002700       1.320300    
 H  -0.6676000     -7.3500000E-02   1.453500    
 H  -0.5698000       1.122100      0.1640000    
 H    6.626200       1.381400      0.7335000    
 H   -2.046000     -0.3367000      -1.262700    
 H   -2.178500      -1.474400      7.4699998E-02
 H   -3.220200      0.3452000       1.485400    
 H   -3.114000       1.448200      0.1296000    
 H    8.001900      0.6720000      -1.913200    
 H    7.714100       2.319800      -1.329700    
 H    6.346600       1.277700      -1.710000    
 H    9.002700       2.058600      0.7707000    
 H    8.733400      0.6737000       1.837200    
 H    9.500500      0.4372000      0.2563000    
 H   -4.583000     -5.2499998E-02  -1.227400    
 H   -4.682000      -1.183800      0.1441000    
 H   -7.925300      0.2342000      -2.093500    
 H   -8.111200      -1.746800      0.2279000    


%chk=000170946-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170946

0 1
P -7.301147 0.287797 0.022918
O -5.675753 0.559597 0.421884
O -7.256678 0.323373 -1.705130
O -7.464987 -1.400811 0.349649
O -8.373270 1.234250 0.704665
C 3.084973 -0.899712 -0.293926
C 4.434198 -0.383381 0.255235
C 1.858880 -0.177034 0.307896
C 5.653799 -1.090091 -0.381064
C 0.512242 -0.701864 -0.239189
C 7.015507 -0.707148 0.249914
C -0.713669 0.037949 0.341228
C 7.411162 0.793440 0.165443
C -2.057413 -0.492885 -0.207474
C -3.276004 0.272894 0.362342
C 7.497038 1.292085 -1.297165
C 8.753828 1.029560 0.897343
C -4.588668 -0.271784 -0.195339
H 3.071813 -0.784126 -1.398363
H 3.003400 -1.989386 -0.096103
H 4.498826 0.710289 0.082278
H 4.462651 -0.526112 1.356270
H 1.938324 0.911217 0.102570
H 1.874486 -0.286016 1.412634
H 5.668707 -0.883383 -1.470479
H 5.518194 -2.187307 -0.281574
H 0.506405 -0.608097 -1.345538
H 0.425756 -1.786689 -0.019194
H 7.818214 -1.303531 -0.234202
H 7.006507 -1.007023 1.319271
H -0.707939 -0.051339 1.447404
H -0.628761 1.121337 0.115760
H 6.632661 1.388947 0.686774
H -2.054018 -0.416438 -1.314719
H -2.148408 -1.572712 0.032321
H -3.292484 0.194202 1.465765
H -3.198344 1.348044 0.113124
H 8.238047 0.698312 -1.867646
H 7.812309 2.351692 -1.335119
H 6.526231 1.212850 -1.819524
H 9.037179 2.098729 0.882970
H 8.698043 0.705329 1.953654
H 9.568659 0.457832 0.411321
H -4.648223 -0.166831 -1.294705
H -4.754479 -1.328206 0.086582
H -7.998050 0.835169 -2.116134
H -8.317642 -1.647389 0.788375


