%chk=000102276.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102276

0 1
 P   -3.568100      -1.519800      0.1571000    
 O  -0.4437000       1.323600       1.020100    
 O  -0.9043000       4.144400     -7.6700002E-02
 O   -2.766300     -0.1936000      0.6235000    
 O    3.566800       1.735000      0.3898000    
 O   -2.567400      -2.220900     -0.9022000    
 O   -4.741400     -0.9203000     -0.7803000    
 O   -4.039200      -2.402400       1.275800    
 N    1.602900      0.5456000      0.1950000    
 N    3.743800     -0.5038000      7.5400002E-02
 N    3.966100      -2.781500     -0.2443000    
 C   -1.009700       2.862600     -0.6923000    
 C   -1.573000       1.855600      0.3009000    
 C   0.3714000       2.321700     -0.9818000    
 C   0.7665000       1.699900      0.3477000    
 C   -2.287700      0.6928000     -0.3751000    
 C   0.9903000     -0.6723000      1.3200000E-02
 C    3.001700      0.6519000      0.2289000    
 C    1.678100      -1.807400     -0.1388000    
 C    3.169100      -1.667200     -9.7900003E-02
 C    1.044200      -3.144100     -0.3382000    
 H   -1.627400       2.976900      -1.588000    
 H   -2.231100       2.324300       1.041000    
 H   0.3124000       1.562800      -1.771400    
 H    1.092500       3.081500      -1.299500    
 H    1.267200       2.444600      0.9778000    
 H   -1.642400      0.1563000      -1.074100    
 H   -3.142600       1.078400     -0.9408000    
 H  -0.4879000       4.742700     -0.7204000    
 H  -8.5600004E-02 -0.7179000      1.0000000E-03
 H    1.347200      -3.835600      0.4547000    
 H    1.336100      -3.567600      -1.304500    
 H  -4.8200000E-02  -3.085400     -0.3192000    
 H    3.586500      -3.711400     -0.3833000    
 H    4.977000      -2.699800     -0.2182000    
 H   -2.808900      -3.094600      -1.277100    
 H   -5.433000      -1.526700      -1.121100    


%chk=000102276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102276

0 1
P -3.693433 -1.407308 0.135582
O -0.662869 1.068823 0.802407
O -0.832698 4.191488 0.229694
O -3.437246 0.248265 0.425317
O 3.285409 1.809985 -0.168410
O -2.155574 -1.892171 -0.477769
O -4.543463 -1.553738 -1.375791
O -4.335307 -2.171933 1.356045
N 1.500576 0.320790 0.090295
N 3.744049 -0.501746 -0.273696
N 4.148703 -2.780144 -0.394153
C -0.987899 3.007980 -0.629282
C -1.714943 1.955659 0.247242
C 0.359564 2.336083 -0.959695
C 0.651547 1.515823 0.315865
C -2.726064 1.126103 -0.544722
C 0.997157 -0.963063 0.105254
C 2.916828 0.595767 -0.125177
C 1.828269 -2.059104 -0.063898
C 3.238136 -1.755902 -0.243343
C 1.300113 -3.476629 -0.028667
H -1.560801 3.268734 -1.543088
H -2.215098 2.461263 1.091420
H 0.250333 1.654876 -1.823798
H 1.175348 3.044025 -1.173192
H 1.154881 2.137404 1.077784
H -2.230005 0.517865 -1.322601
H -3.493204 1.780011 -0.997212
H -0.199417 4.824172 -0.194742
H -0.079800 -1.060918 0.265104
H 1.764501 -4.070215 0.784364
H 1.482437 -4.014523 -0.981093
H 0.212041 -3.476120 0.154739
H 3.872648 -3.757055 -0.367945
H 5.128871 -2.525336 -0.503641
H -2.204711 -2.628448 -1.139610
H -5.526978 -1.642466 -1.292886


