%chk=000137401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137401

0 1
 P  -0.4841000       2.213600     -0.7794000    
 P   -3.056500       3.510700     -0.1840000    
 O    1.982900     -0.9039000      -1.664900    
 O    1.276500      -3.782600      -1.213500    
 O    3.080200      -3.293900      0.7730000    
 O  -0.2030000      0.7597000      -1.420100    
 O   -2.092100       2.294000     -0.6328000    
 O    5.786800      -1.736700     -0.3513000    
 O  -0.1685000       3.255300      -1.976300    
 O   0.2641000       2.487500      0.4930000    
 O    6.163000       2.659500      0.9816000    
 O  -0.2990000      -1.186600       2.764100    
 O   -1.069500      0.8501000       2.486000    
 O   -4.515800       2.820500     -0.1045000    
 O   -2.661100       3.739300       1.366300    
 O   -2.970500       4.730700      -1.052700    
 N    3.864200     -0.4093000     -0.3685000    
 N    5.972000      0.4527000      0.3129000    
 N   -1.048100     -0.3662000       2.182900    
 N   -5.324800      -2.174600      0.7910000    
 N   -6.148000      -1.990300     -0.1320000    
 N   -6.904300      -1.824800     -0.9705000    
 C   0.7107000      -1.465000      -1.273300    
 C    1.035900      -2.651700     -0.3765000    
 C    2.322200      -2.205600      0.2860000    
 C    3.019000      -1.467300     -0.8440000    
 C  -8.9800000E-02 -0.3786000     -0.5677000    
 C   -1.472600     -0.8500000     -0.1823000    
 C    5.241600     -0.6490000     -0.1523000    
 C    3.328100      0.8491000     -0.1213000    
 C   -1.901800     -0.8310000       1.144800    
 C   -2.326000      -1.310500      -1.184900    
 C    4.037000       1.889500      0.3220000    
 C   -3.184600      -1.272500       1.469300    
 C   -3.608700      -1.752100     -0.8603000    
 C   -4.038000      -1.733000      0.4667000    
 C    5.482600       1.723100      0.5737000    
 H   0.2286000      -1.772600      -2.207700    
 H   0.2619000      -2.937200      0.3398000    
 H    2.106300      -1.534500       1.125400    
 H    3.606400      -2.154900      -1.464400    
 H   0.4762000     -5.6400001E-02  0.3074000    
 H   0.4337000      -4.011300      -1.641500    
 H    2.524200      -3.775600       1.408800    
 H    2.276800      0.9896000     -0.3066000    
 H   -2.017000      -1.326300      -2.226300    
 H    6.964000      0.3032000      0.4752000    
 H    3.584800       2.857200      0.5010000    
 H   -3.525200      -1.259400       2.502600    
 H   -4.228000      -2.124100      -1.671800    
 H  -0.1414000       4.214800      -1.774400    
 H   -5.298300       3.383500      7.6800004E-02
 H   -3.056000       4.495200       1.850700    


%chk=000137401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137401

0 1
P 0.091977 2.178272 -0.519324
P -2.402938 3.789521 0.384313
O 1.579460 -0.349564 -1.050943
O 1.424069 -3.521712 -0.079783
O 3.425508 -2.485442 1.341451
O -0.844556 0.780310 -0.942318
O -1.067749 3.435705 -0.654533
O 5.172593 -1.196428 -2.092287
O 0.977017 2.500354 -1.932241
O 0.841693 2.094902 0.875659
O 7.031023 2.761413 -0.445797
O -1.211743 -0.899933 2.842733
O -3.151831 0.269967 3.104711
O -3.728222 3.675213 -0.694489
O -2.490745 2.281020 1.170683
O -2.301798 5.118196 1.230075
N 3.903191 0.068698 -0.545042
N 6.051384 0.792540 -1.232411
N -2.377726 -0.522940 2.439678
N -6.059063 -2.489003 -0.025518
N -6.628308 -2.975203 -1.050753
N -7.338104 -3.453624 -1.868570
C 0.482061 -1.263949 -0.602134
C 1.091457 -2.200502 0.479234
C 2.464869 -1.549673 0.817401
C 2.864988 -0.945032 -0.555037
C -0.658831 -0.387359 -0.034945
C -2.016061 -1.060624 0.004855
C 5.061424 -0.184113 -1.350538
C 3.792833 1.225332 0.240881
C -2.865891 -1.043796 1.141919
C -2.577982 -1.572607 -1.191192
C 4.789771 2.162231 0.309235
C -4.195023 -1.496011 1.118172
C -3.892373 -2.068143 -1.247219
C -4.711007 -2.029203 -0.084818
C 6.034801 1.987445 -0.437111
H 0.153053 -1.857508 -1.474418
H 0.447687 -2.294306 1.371757
H 2.343876 -0.756387 1.573682
H 3.198504 -1.739013 -1.248141
H -0.353190 -0.010458 0.956015
H 0.715187 -4.177786 0.122709
H 3.284012 -3.344403 0.855315
H 2.836834 1.367490 0.756839
H -1.984917 -1.536932 -2.110049
H 6.898557 0.629235 -1.786587
H 4.671642 3.061436 0.913793
H -4.823063 -1.441378 2.010741
H -4.289073 -2.459566 -2.190423
H 1.489436 1.686737 -2.203467
H -3.965133 4.526889 -1.144586
H -2.986581 2.210993 2.028022


