%chk=000167958.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167958

0 1
 P    4.614700       1.329900     -0.3845000    
 O   0.5520000     -0.1898000     -0.4491000    
 O  -0.9888000      -3.360000      4.2800002E-02
 O    1.380700      -2.717700       1.947500    
 O    3.128800      0.8514000      4.2500000E-02
 O   -3.102300      -1.505900      -1.849100    
 O   -5.040500       2.106000      0.2357000    
 O    4.899500      0.5209000      -1.755500    
 O    5.558300      0.5793000      0.6930000    
 O    4.803600       2.816500     -0.4655000    
 N   -1.784300     -0.2478000     -0.3892000    
 N   -4.056200      0.2986000     -0.8031000    
 C  -0.4697000      -2.122000      0.4938000    
 C    1.029100      -2.201400      0.6786000    
 C    1.422000     -0.7404000      0.5525000    
 C  -0.6005000      -1.039800     -0.5665000    
 C    2.869300     -0.5395000      0.1416000    
 C   -1.732200      0.8413000      0.4731000    
 C   -2.982200     -0.5576000      -1.070600    
 C   -2.761800       1.658500      0.7269000    
 C   -4.057400       1.394900      4.6100002E-02
 C   -2.682100       2.824600       1.659100    
 H  -0.9729000      -1.868600       1.434100    
 H    1.497600      -2.822100     -9.4599999E-02
 H  -0.5998000      -1.464700      -1.577300    
 H    1.236500     -0.1952000       1.487000    
 H    3.050600     -0.9971000     -0.8365000    
 H    3.540900     -0.9891000      0.8793000    
 H  -0.5391000      -3.598700     -0.7855000    
 H    1.002900      -3.611400       2.012600    
 H  -0.7938000       1.020400      0.9851000    
 H   -4.928400      9.3699999E-02  -1.282800    
 H   -2.905900       3.755100       1.127400    
 H   -1.686300       2.927000       2.103200    
 H   -3.400600       2.709700       2.477200    
 H    5.728500      0.6998000      -2.248500    
 H    6.518200      0.7807000      0.7050000    


%chk=000167958-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167958

0 1
P 4.596911 1.542336 0.229557
O 0.665179 -0.342319 -0.561305
O -0.843336 -3.602683 -0.529074
O 1.476980 -3.140765 1.644653
O 3.153333 0.735275 0.641620
O -3.149062 -2.082677 -0.694484
O -5.063594 1.946605 0.713059
O 4.809422 1.336734 -1.480879
O 5.735614 0.379535 0.766170
O 4.668248 3.032417 0.747280
N -1.734252 -0.258117 -0.259262
N -4.058327 -0.041378 0.012065
C -0.412569 -2.403744 0.150732
C 1.105569 -2.471418 0.409341
C 1.490568 -0.984046 0.513262
C -0.567545 -1.103972 -0.703214
C 2.951086 -0.689311 0.254192
C -1.577436 1.077771 0.124856
C -2.994577 -0.869009 -0.336191
C -2.636832 1.885066 0.472564
C -3.998140 1.330110 0.427638
C -2.473810 3.323202 0.896741
H -0.934743 -2.268363 1.122642
H 1.581949 -2.944984 -0.475635
H -0.712243 -1.354907 -1.769907
H 1.194869 -0.589166 1.505108
H 3.204105 -0.830478 -0.812758
H 3.585780 -1.329649 0.891258
H -1.817488 -3.467334 -0.719295
H 1.206035 -4.091343 1.582263
H -0.541533 1.424719 0.119430
H -4.991589 -0.464104 -0.031966
H -3.051025 3.993296 0.234276
H -1.414876 3.630843 0.879267
H -2.871070 3.477351 1.916442
H 4.486229 2.100465 -2.024115
H 6.680568 0.553544 0.529467


