%chk=000003123.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003123

0 1
 P   -5.153500      0.2126000      6.9600001E-02
 O   -6.278900     -0.8175000     -0.4437000    
 O   -5.112100     -1.6899999E-02   1.662200    
 O   -5.292300       1.621200     -0.3892000    
 O    5.217700       1.708600     -0.3314000    
 O    6.077100     -4.2900000E-02  0.8228000    
 N    4.175200      -1.737500      2.8700000E-02
 C   0.1361000      0.1956000      0.1018000    
 C   -1.100400     -0.5223000     -0.4440000    
 C    1.424000     -0.4580000     -0.4046000    
 C   -2.387300      0.1484000      3.3000000E-02
 C    2.696500      0.2252000      0.1125000    
 C   -3.623100     -0.5797000     -0.4771000    
 C    4.010000     -0.3539000     -0.4293000    
 C    5.211200      0.4169000      8.8500001E-02
 H   0.1165000       1.248600     -0.2038000    
 H   0.1213000      0.1759000       1.198200    
 H   -1.072700     -0.5229000      -1.540500    
 H   -1.088400      -1.569900     -0.1195000    
 H    1.431200     -0.4380000      -1.501500    
 H    1.428200      -1.513200     -0.1061000    
 H   -2.413300       1.190500     -0.3068000    
 H   -2.408300      0.1766000       1.128800    
 H    2.643200       1.289800     -0.1512000    
 H    2.700900      0.1954000       1.210800    
 H   -3.621700      -1.617400     -0.1254000    
 H   -3.623100     -0.6025000      -1.572400    
 H    4.029300     -0.3361000      -1.524000    
 H    4.195500      -1.770100       1.047300    
 H    5.068600      -2.106200     -0.2946000    
 H   -7.224800     -0.6062000     -0.2931000    
 H   -5.833900      0.3481000       2.216900    
 H    5.989700       2.202700      1.7899999E-02


%chk=000003123-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000003123

0 1
P -5.236959 0.174078 0.102558
O -6.371271 -0.888567 -0.674814
O -5.193277 -0.328633 1.766802
O -5.578812 1.723128 -0.077072
O 5.413330 1.518360 -0.861995
O 5.994710 0.337983 1.053975
N 4.138057 -1.763491 0.279634
C 0.169946 0.196197 0.144901
C -1.093493 -0.456654 -0.460139
C 1.478992 -0.396109 -0.422481
C -2.401606 0.123400 0.125113
C 2.737405 0.293795 0.143358
C -3.641590 -0.542588 -0.505892
C 4.048129 -0.420548 -0.305545
C 5.247898 0.473408 0.059510
H 0.141556 1.289882 -0.042865
H 0.156838 0.067591 1.247149
H -1.086022 -0.315753 -1.561018
H -1.061025 -1.551346 -0.282668
H 1.477286 -0.297528 -1.528365
H 1.538942 -1.477811 -0.197139
H -2.432179 1.217012 -0.050035
H -2.420047 -0.028860 1.221015
H 2.771849 1.349970 -0.186108
H 2.700810 0.297039 1.252365
H -3.683691 -1.622233 -0.279428
H -3.652618 -0.422203 -1.603823
H 4.025834 -0.509430 -1.407367
H 4.287072 -1.738743 1.295579
H 4.826729 -2.370819 -0.176865
H -7.279338 -0.505406 -0.778480
H -5.756633 0.221180 2.368633
H 6.171578 2.098600 -0.577694


