%chk=000031002.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031002

0 1
 P    2.152000      0.2093000     -4.2300001E-02
 O   0.5720000      0.3126000     -0.3680000    
 O    2.567800      -1.247000     -0.6094000    
 O    2.172800      3.7000000E-03   1.561600    
 O    2.981400       1.354400     -0.5453000    
 N   -2.566100      -1.567400      7.5199999E-02
 C   -1.725300     -0.4419000     -0.3331000    
 C   -2.223200      0.8776000      0.2865000    
 C  -0.2788000     -0.7366000      7.7500001E-02
 C   -3.652500       1.235300     -0.1028000    
 H   -1.765600     -0.3474000      -1.425200    
 H   -2.153800      0.8331000       1.380900    
 H   -1.570900       1.698800     -3.4899998E-02
 H  -0.1993000     -0.8290000       1.166500    
 H   5.3399999E-02  -1.678000     -0.3741000    
 H   -3.773100       1.243000      -1.190600    
 H   -3.902600       2.233200      0.2720000    
 H   -4.376200      0.5346000      0.3240000    
 H   -3.518900      -1.432900     -0.2582000    
 H   -2.621700      -1.607500       1.092300    
 H    3.510600      -1.515800     -0.5809000    
 H    3.035300      3.4000000E-03   2.028900    


%chk=000031002-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031002

0 1
P 2.225075 0.285939 0.037668
O 0.550454 0.303551 -0.240695
O 2.844480 -1.218667 -0.576991
O 2.248238 -0.103529 1.710230
O 2.984524 1.570768 -0.482900
N -2.607570 -1.595819 0.272813
C -1.767813 -0.471007 -0.189327
C -2.233318 0.929778 0.286260
C -0.334517 -0.791826 0.278696
C -3.617657 1.323096 -0.268856
H -1.769508 -0.485398 -1.296775
H -2.254057 0.936677 1.397070
H -1.474357 1.673294 -0.019950
H -0.260745 -0.809292 1.381823
H -0.005188 -1.760645 -0.134113
H -3.602935 1.367708 -1.374692
H -3.927125 2.317102 0.101131
H -4.395663 0.595739 0.031111
H -3.359340 -1.877927 -0.357561
H -2.906436 -1.534822 1.250192
H 3.252647 -1.144411 -1.477356
H 3.128111 -0.374809 2.072822


