%chk=000147085.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147085

0 1
 P   -3.971100       1.000200     -0.2497000    
 O  -0.3956000      -1.492200     -0.9787000    
 O  -0.8986000      -4.253500      0.1651000    
 O   -2.662200      0.1016000     -0.5641000    
 O    3.527100      -2.129100     -0.4103000    
 O   -3.597600       1.752300       1.132300    
 O   -5.062300     -0.1013000      0.2095000    
 O   -4.408800       1.897200      -1.370400    
 O    4.270400       2.337400      0.1297000    
 N    1.753000     -0.8232000     -0.2234000    
 N    3.986700      8.1200004E-02 -0.1445000    
 N    1.584400       2.851100      0.2328000    
 N   0.1693000       3.093300      0.2820000    
 N  -0.8997000       3.289000      0.3206000    
 C  -0.9619000      -2.971200      0.7852000    
 C   -1.520700      -1.972900     -0.2176000    
 C   0.4394000      -2.459700       1.024000    
 C   0.8220000      -1.915300     -0.3436000    
 C   -2.184800     -0.7731000      0.4450000    
 C    1.278300      0.4819000     -5.5199999E-02
 C    3.177500     -0.9415000     -0.2588000    
 C    2.035700       1.577200      6.8700001E-02
 C    3.519500       1.370500      2.1400001E-02
 H   -1.550100      -3.066300       1.702300    
 H   -2.212500      -2.435100     -0.9307000    
 H   0.4206000      -1.666000       1.780500    
 H    1.136500      -3.233800       1.360200    
 H    1.198800      -2.722600     -0.9830000    
 H   -1.493100     -0.2128000       1.079400    
 H   -3.009100      -1.118700       1.076900    
 H   -1.812200      -4.537300     -9.8000001E-03
 H   0.2025000      0.5639000     -3.1500001E-02
 H    2.264400       3.598300      0.3148000    
 H   -4.221700       2.416600       1.494700    
 H   -5.986300      0.1850000      0.3718000    


%chk=000147085-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147085

0 1
P -3.828062 1.146382 -0.210674
O -0.415029 -1.677392 -1.097809
O -0.875057 -4.547395 -0.076791
O -2.486539 0.085409 -0.395129
O 3.426923 -1.989441 0.423871
O -3.373119 2.319015 0.957966
O -4.837858 0.167561 0.772736
O -4.374996 1.694311 -1.585704
O 3.782208 2.668682 0.652269
N 1.552628 -0.698800 -0.115881
N 3.649465 0.359091 0.517694
N 1.150240 3.015823 0.020688
N -0.067231 3.286656 -0.139388
N -1.171792 3.707870 -0.270051
C -0.968684 -3.263195 0.622640
C -1.559576 -2.145877 -0.278131
C 0.481599 -2.797528 0.860180
C 0.835767 -1.990745 -0.418767
C -2.176710 -1.012129 0.554432
C 0.929452 0.514637 -0.240650
C 2.953780 -0.829131 0.297236
C 1.641975 1.673265 0.051517
C 3.040241 1.530152 0.411273
H -1.538183 -3.372274 1.569182
H -2.306029 -2.515627 -1.002110
H 0.556765 -2.162479 1.759081
H 1.151051 -3.659054 0.987943
H 1.489150 -2.556714 -1.101086
H -1.474642 -0.624139 1.316271
H -3.102429 -1.355904 1.049602
H -1.777245 -4.860377 -0.341296
H -0.109123 0.499936 -0.594647
H 3.209341 3.476454 0.534323
H -2.822611 3.076881 0.603537
H -5.647873 0.607173 1.131272


