%chk=000096085.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096085

0 1
 P    1.164400     -2.1700000E-02 -0.3649000    
 O    1.506700     -0.3519000      -1.799800    
 N    1.190800      -1.345600      0.6419000    
 N    2.211400       1.061400      0.3410000    
 N  -0.3536000      0.6273000     -0.1564000    
 C    2.482500      -1.991700      0.8239000    
 C    1.402100      -2.638800      7.4999998E-03
 C    2.382400       2.333700     -0.3452000    
 C    1.612800       2.245500      0.9402000    
 C   -1.524200     -0.1842000     -0.4682000    
 C   -2.779600      0.4400000      0.1388000    
 C   -4.023300     -0.3847000     -0.1945000    
 C   -5.272300      0.2106000      0.4357000    
 H    2.675800      -2.383100       1.813000    
 H    3.336200      -1.582800      0.3012000    
 H    1.530000      -2.689700      -1.063700    
 H   0.8627000      -3.467000      0.4476000    
 H    1.835100       2.484700      -1.265400    
 H    3.378100       2.754000     -0.3136000    
 H    2.103400       2.600000       1.839900    
 H   0.5626000       2.485200      0.9093000    
 H  -0.4995000       1.542700     -0.5832000    
 H   -1.405400      -1.195700     -6.6100001E-02
 H   -1.625900     -0.2731000      -1.555500    
 H   -2.909500       1.461900     -0.2396000    
 H   -2.667200      0.5114000       1.228200    
 H   -3.896400      -1.412600      0.1649000    
 H   -4.156300     -0.4349000      -1.281500    
 H   -6.149100     -0.3940000      0.1836000    
 H   -5.184300      0.2430000       1.526400    
 H   -5.446600       1.229100      7.4299999E-02


%chk=000096085-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096085

0 1
P 1.359835 -0.036708 -0.754427
O 2.280033 0.056327 -2.063535
N 1.368932 -1.527488 0.224660
N 1.887405 1.100677 0.520484
N -0.329667 0.138071 -1.133253
C 2.704491 -2.151774 0.550917
C 1.786876 -2.813108 -0.462990
C 1.703392 2.581856 0.302790
C 0.884755 1.858175 1.359409
C -1.470457 -0.460052 -0.406451
C -2.654645 0.521091 -0.269062
C -3.873077 -0.122942 0.432082
C -5.068983 0.845098 0.559390
H 2.776845 -2.548322 1.567847
H 3.606579 -1.659866 0.167712
H 2.082116 -2.750798 -1.518122
H 1.195684 -3.688575 -0.178995
H 1.178069 2.916778 -0.601233
H 2.566083 3.189267 0.591023
H 1.151502 1.938854 2.417338
H -0.181936 1.713855 1.145425
H -0.508321 0.451991 -2.090802
H -1.110390 -0.779426 0.587553
H -1.819564 -1.380529 -0.922864
H -2.958332 0.876185 -1.276140
H -2.326093 1.418766 0.292568
H -3.572009 -0.475960 1.439381
H -4.184888 -1.024639 -0.133370
H -5.928045 0.361754 1.059511
H -4.795016 1.740290 1.148773
H -5.407374 1.190151 -0.435819


