%chk=000174619.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174619

0 1
 P    3.695400     -3.2499999E-02   1.270300    
 P    1.602800      -2.074100      0.8519000    
 P   0.1156000      -1.971400      -1.680500    
 O   0.6387000       1.533300     -0.8014000    
 O   0.6150000       4.470800      -1.750900    
 O    3.238100      0.9251000      4.9100000E-02
 O    2.358500     -0.8696000       1.618000    
 O    4.638200      -1.134300      0.5532000    
 O    4.326200      0.6739000       2.434800    
 O    1.065200      -1.391500     -0.5089000    
 O   0.2572000      -2.287700       1.722200    
 O    2.431500      -3.310500      0.6619000    
 O    1.014900      -3.129200      -2.366400    
 O   0.1367000     -0.7947000      -2.790100    
 O   -1.256600      -2.399300      -1.249000    
 N   -1.415200       1.230200      0.3464000    
 N   -2.003900     -4.0199999E-02   2.081100    
 N   -3.313900      0.8419000      -1.118100    
 N   -4.926200     -0.6777000     -9.4800003E-02
 N   -4.601900      -1.619900       2.081000    
 C   0.9689000       3.874800     -0.5048000    
 C    1.668700       2.543300     -0.7559000    
 C  -0.6206000       2.142500     -0.4679000    
 C  -0.3007000       3.468100      0.2080000    
 C    2.642800       2.173700      0.3542000    
 C   -2.616900      0.6717000      1.5400000E-02
 C   -1.088600      0.7722000       1.595300    
 C   -2.964900     -0.1119000       1.104000    
 C   -4.169800     -0.8028000       1.022200    
 C   -4.458200      0.1249000      -1.081000    
 C    2.323000      -2.799200      -2.799500    
 H    1.567100       4.598100      5.6600001E-02
 H    2.179800       2.516600      -1.724800    
 H   -1.156800       2.311200      -1.409000    
 H   -1.121600       4.183300      9.6400000E-02
 H  -9.6500002E-02   3.342600       1.276900    
 H    3.435700       2.922400      0.4453000    
 H    2.120500       2.094500       1.314000    
 H    1.442200       4.682100      -2.216400    
 H  -0.1736000       1.053100       2.098700    
 H   -5.089000      0.2013000      -1.960200    
 H   -5.481100      -2.111900       1.997700    
 H   -4.038900      -1.715200       2.915400    
 H    5.109500      -1.789800       1.110300    
 H  -0.3328000      -3.041100       1.506800    
 H  -0.4467000     -0.8720000      -3.574800    
 H    2.816300      -3.713500      -3.138800    
 H    2.909600      -2.367600      -1.985500    
 H    2.274700      -2.096900      -3.635500    


%chk=000174619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174619

0 1
P 4.610548 -0.017574 1.836798
P 3.570081 -2.058735 -0.294335
P 0.730456 -2.240373 -1.634553
O 0.077469 1.300413 1.011055
O 1.849238 2.033154 -1.894226
O 3.776903 1.375489 1.216195
O 3.525718 -1.329590 1.273276
O 5.947820 -0.084977 0.827642
O 4.797848 -0.065547 3.398538
O 2.166869 -1.349842 -1.031381
O 3.212821 -3.669489 -0.109969
O 4.941454 -1.637792 -1.004906
O 0.951301 -2.163349 -3.328276
O -0.531246 -1.334045 -1.210376
O 0.911929 -3.753918 -1.112816
N -2.113818 1.673074 0.203112
N -4.098691 2.341496 1.150671
N -2.635025 -0.774932 0.031711
N -4.825385 -1.361817 0.868442
N -6.302225 0.248206 1.745478
C 1.454550 2.547909 -0.574651
C 1.478854 1.415529 0.514818
C -0.706345 1.649133 -0.194160
C -0.040107 2.945196 -0.685065
C 2.395961 1.635126 1.713354
C -2.893248 0.534062 0.345618
C -2.888059 2.732993 0.721633
C -4.114158 0.954207 0.924115
C -5.101066 -0.041378 1.188274
C -3.640199 -1.669036 0.316710
C 0.687596 -0.875147 -4.025391
H 2.097763 3.402355 -0.291936
H 1.740008 0.461306 0.019200
H -0.580129 0.846590 -0.949132
H -0.291541 3.213436 -1.722830
H -0.262052 3.787830 -0.007781
H 2.384922 2.672418 2.087567
H 2.125252 0.946897 2.534739
H 2.741219 1.606249 -1.818737
H -2.519823 3.754411 0.751317
H -3.439709 -2.714053 0.069385
H -6.965146 -0.506719 1.920515
H -6.529796 1.209532 1.998401
H 5.788806 -0.655568 -0.029692
H 2.227833 -3.927362 -0.480701
H -1.694020 -1.108623 -0.466416
H 1.103533 -1.026396 -5.031862
H 1.192502 -0.032767 -3.519276
H -0.399066 -0.690881 -4.077197


