%chk=000001463.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001463

0 1
 P   -3.880800      -1.467100      0.3352000    
 O  -0.7771000       2.107500     -0.9163000    
 O   -3.617900      5.1300000E-02 -0.1473000    
 O   -5.481200      -1.647500      0.1884000    
 O   -3.662300      -1.372800       1.934700    
 O   -3.051600      -2.508800     -0.3575000    
 N   0.9735000      0.6674000     -0.2244000    
 N    2.322100      0.9598000       1.531100    
 N    2.362900     -0.8024000      -1.570900    
 N    4.487600      -1.275700     -0.4673000    
 N    5.053600     -0.3682000       1.673500    
 C   -2.317800      0.5838000      2.0000001E-03
 C   -1.300900     -0.2232000     -0.7746000    
 C  -0.2079000      0.7949000      -1.078800    
 C   -2.177700       1.955000     -0.6372000    
 C   -2.648600       3.091100      0.2526000    
 C    2.103000     -5.9300002E-02 -0.4847000    
 C    1.156000       1.261200      0.9989000    
 C    2.924200      0.1349000      0.6144000    
 C    4.157900     -0.5082000      0.5993000    
 C    3.583000      -1.373700      -1.471300    
 H   -2.046300      0.6159000       1.063900    
 H   0.1407000      0.7040000      -2.113600    
 H  -0.9317000      -1.095100     -0.2259000    
 H   -1.736100     -0.5850000      -1.714700    
 H   -2.721900       1.999400      -1.589100    
 H   -2.076800       3.122000       1.186400    
 H   -2.488300       4.054200     -0.2436000    
 H   -3.711200       2.992700      0.4935000    
 H   0.4094000       1.896200       1.456000    
 H    3.880000      -1.996100      -2.308600    
 H   -5.878400      -2.525500      0.3710000    
 H   -3.673400      -2.198100       2.464600    
 H    4.810000      0.2042000       2.470500    
 H    5.944100     -0.8455000       1.639000    


%chk=000001463-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001463

0 1
P -3.734028 -1.824562 0.071110
O -1.063758 2.357404 -1.162018
O -3.442748 -0.173351 -0.273160
O -5.419410 -1.758024 0.375337
O -3.065084 -1.900049 1.649461
O -3.273529 -2.940983 -0.960269
N 0.921290 1.118570 -0.615021
N 2.643450 1.909480 0.690076
N 1.589049 -1.294487 -0.711300
N 3.650058 -1.727601 0.562357
N 4.820936 -0.030675 1.719140
C -2.056825 0.361336 -0.198062
C -1.183986 -0.021251 -1.413471
C -0.257000 1.198054 -1.536368
C -2.193016 1.903753 -0.274510
C -2.137432 2.629636 1.069473
C 1.734270 0.009836 -0.325187
C 1.526979 2.226008 0.008726
C 2.784366 0.524533 0.485824
C 3.765845 -0.408182 0.933599
C 2.589637 -2.087373 -0.224153
H -1.606835 0.036018 0.757243
H 0.110934 1.375957 -2.560686
H -0.633632 -0.968202 -1.301556
H -1.822700 -0.066458 -2.312681
H -3.127722 2.144902 -0.813569
H -1.202944 2.399711 1.611110
H -2.198641 3.721380 0.922667
H -2.993261 2.314858 1.694258
H 1.092339 3.218603 -0.067971
H 2.539006 -3.145958 -0.496076
H -5.969642 -2.155934 -0.346853
H -2.886266 -2.813593 1.987086
H 4.921534 0.943129 1.997649
H 5.498866 -0.733190 2.006997


