%chk=000001042.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001042

0 1
 P   -3.863300      -1.638900     -0.2485000    
 O  -0.7180000      5.9900001E-02  2.1800000E-02
 O   -1.322100       3.347800       1.316400    
 O   0.9885000       3.099800     -0.7270000    
 O   -3.330700     -0.5836000      0.8568000    
 O    2.779800      0.6756000      -2.100600    
 O   -2.726700      -1.597400      -1.398200    
 O   -5.105400     -0.8554000     -0.9253000    
 O   -4.188800      -3.004000      0.2830000    
 O    5.061600      -2.110800      0.7847000    
 N    3.932200     -0.7158000     -0.6658000    
 N    2.920000      -1.453000       1.308200    
 C   -1.071900       2.374700      0.3203000    
 C   0.4130000       2.144400      0.1463000    
 C   -1.538600      0.9929000      0.7444000    
 C   0.4432000      0.7530000     -0.4722000    
 C   -3.001200      0.7295000      0.4336000    
 C    1.668600     -1.9200001E-02 -0.1173000    
 C    2.825300      2.5599999E-02  -1.059300    
 C    1.788600     -0.7500000      0.9980000    
 C    4.045900      -1.475200      0.5006000    
 H   -1.532500       2.707900     -0.6168000    
 H   0.9367000       2.200900       1.108700    
 H   -1.359300      0.8156000       1.812700    
 H   0.3254000      0.8013000      -1.561500    
 H   -3.192300      0.8502000     -0.6382000    
 H   -3.644200       1.431300      0.9740000    
 H  -0.9216000       3.045500       2.149100    
 H    1.921500       2.856900     -0.8533000    
 H   0.9973000     -0.8285000       1.734200    
 H    4.736600     -0.7056000      -1.286400    
 H    2.926900      -1.981000       2.175900    
 H   -2.796400      -2.214900      -2.157100    
 H   -5.665100      -1.327200      -1.578200    


%chk=000001042-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001042

0 1
P -4.570567 -1.749364 -0.004438
O -0.335780 -0.102072 -0.456882
O -1.669189 3.143979 0.765708
O 1.112281 3.251505 -0.775850
O -3.098606 -0.962122 0.330747
O 3.547534 1.955376 -0.497929
O -4.597723 -1.607168 -1.712579
O -5.845760 -0.627579 0.362999
O -4.709098 -3.165795 0.681191
O 5.453673 -1.910568 1.324691
N 4.457415 0.006283 0.392349
N 3.151728 -1.888447 0.857659
C -1.003650 2.191053 -0.109309
C 0.536756 2.152689 -0.041248
C -1.388665 0.719232 0.199522
C 0.862714 0.754915 -0.664435
C -2.753026 0.330829 -0.332988
C 2.079138 0.054035 -0.097019
C 3.362982 0.755698 -0.101285
C 2.023580 -1.237500 0.376245
C 4.438209 -1.310872 0.891531
H -1.305798 2.479328 -1.131276
H 0.855250 2.162233 1.029774
H -1.360276 0.544315 1.295800
H 0.991043 0.910869 -1.756102
H -2.732279 0.185174 -1.426292
H -3.501374 1.096158 -0.053294
H -1.187207 3.197230 1.630151
H 2.102937 3.085116 -0.802997
H 1.076219 -1.782072 0.384462
H 5.370584 0.473095 0.399384
H 3.095591 -2.846787 1.208446
H -5.455539 -1.833355 -2.150821
H -6.270098 -0.773110 1.247082


