%chk=000000587.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000587

0 1
 P    2.419700      0.5169000     -7.1400002E-02
 O   -3.285900       1.933300      0.3084000    
 O    3.326900     -0.4408000      0.8780000    
 O    2.777700       1.976300      0.5480000    
 O   -2.508700      0.5838000      -1.341700    
 O    2.817700      0.4157000      -1.520700    
 N   -1.121600      -1.041100      0.4153000    
 N   0.8758000      0.2287000      0.2887000    
 N   0.8215000      -1.983000     -0.5281000    
 C   -1.889800      9.0400003E-02  0.9316000    
 C   0.2275000     -0.8880000      6.3500002E-02
 C   -1.880500      -2.267300      0.1824000    
 C   -2.580300      0.8750000     -0.1541000    
 H   -1.245100      0.7757000       1.493100    
 H   -2.656000     -0.2653000       1.630900    
 H   -1.414500      -3.110300      0.7031000    
 H   -1.930400      -2.487700     -0.8890000    
 H   -2.910200      -2.190400      0.5481000    
 H   0.3239000      -2.846200     -0.7105000    
 H    1.794700      -1.959100     -0.8125000    
 H    4.299400     -0.4450000      0.7499000    
 H    3.662500       2.359700      0.3678000    
 H   -3.724500       2.427200     -0.4168000    


%chk=000000587-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000000587

0 1
P 2.607344 0.211036 0.251526
O -3.280275 1.822515 0.872493
O 3.227220 0.369617 1.839476
O 2.932494 1.843681 -0.246868
O -2.693906 0.804739 -1.136773
O 3.324676 -0.862040 -0.717914
N -1.103067 -1.100881 0.292883
N 0.934149 0.014168 0.520110
N 0.800284 -2.019809 -0.780655
C -1.719223 0.011727 1.010333
C 0.250833 -1.027650 -0.002720
C -1.957475 -2.170543 -0.244157
C -2.586331 0.880356 0.104879
H -0.894732 0.633057 1.411889
H -2.330080 -0.340330 1.861789
H -1.524488 -3.167921 -0.039075
H -2.137800 -2.053227 -1.330216
H -2.934747 -2.130636 0.262483
H 0.237743 -2.749195 -1.209484
H 1.816061 -1.948534 -0.981318
H 4.080934 0.870595 1.881108
H 2.964765 1.955174 -1.230773
H -3.814578 2.412602 0.274984


