%chk=000167814.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167814

0 1
 P    5.791100      0.7640000      0.7264000    
 O    2.409400       2.023600      2.1199999E-02
 O    4.479900     -5.8300000E-02  0.2659000    
 O    2.299700      -1.535900     -0.3916000    
 O    5.293600       2.300300      0.6577000    
 O    6.810700      0.6099000     -0.5207000    
 O    6.356400      0.3392000       2.049900    
 O   0.3357000      -1.856800      -1.559100    
 O   -5.929300     -0.4303000       1.128400    
 N   0.2870000      0.9702000     -6.2899999E-02
 N   -1.590900       1.836700     -0.8950000    
 N  -0.6513000     -0.6824000       1.450100    
 N   -3.090800     -0.6582000       1.386700    
 N   -4.312600      0.8386000     -1.6200000E-02
 C    3.779000      0.3427000     -0.9086000    
 C    2.362700     -0.1974000     -0.8404000    
 C    3.496100       1.841600     -0.9149000    
 C    1.717100      0.7636000      0.1541000    
 C    4.659400       2.744200     -0.5340000    
 C  -0.7387000      0.2995000      0.5402000    
 C  -0.2752000       1.883100     -0.9154000    
 C   -1.894200      0.8512000      1.0500000E-02
 C    1.223400      -2.271400     -0.8266000    
 C    1.304300      -3.670600     -0.2602000    
 C   -3.103400      0.3361000      0.4664000    
 C   0.1178000      -4.530400     -0.6890000    
 C   -1.883300      -1.099100       1.815100    
 C   0.2266000      -5.943800     -0.1405000    
 C   -5.615900      0.4438000      0.3271000    
 C   -6.655700       1.233500     -0.4586000    
 C   -8.098200      0.8529000     -0.1326000    
 C   -9.110300       1.660200     -0.9334000    
 H    4.333800     -6.0999999E-03  -1.784100    
 H    1.916600     -8.9299999E-02  -1.839400    
 H    3.110800       2.150500      -1.894900    
 H    1.837700      0.4288000       1.191400    
 H    4.309000       3.765400     -0.3545000    
 H    5.406200       2.772000      -1.333800    
 H   0.3147000       2.549900      -1.529500    
 H    7.300600     -0.2327000     -0.6310000    
 H    1.330300      -3.595600      0.8327000    
 H    2.238000      -4.124700     -0.6100000    
 H   6.0899999E-02  -4.571600      -1.783400    
 H  -0.8175000      -4.075900     -0.3406000    
 H   -1.910700      -1.896300       2.550200    
 H   -4.225000       1.583200     -0.7048000    
 H  -0.6337000      -6.541000     -0.4585000    
 H   0.2507000      -5.938600      0.9539000    
 H    1.134700      -6.436400     -0.5024000    
 H   -6.499700       2.298700     -0.2487000    
 H   -6.464900       1.073100      -1.526800    
 H   -8.286100       1.001900      0.9375000    
 H   -8.252200     -0.2143000     -0.3321000    
 H   -9.007900       2.730200     -0.7267000    
 H   -10.12910       1.358200     -0.6714000    
 H   -8.973400       1.502400      -2.007900    


%chk=000167814-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167814

0 1
P 5.930311 0.695120 0.659436
O 2.411657 2.094716 -0.102068
O 4.474457 -0.129434 0.226874
O 2.247987 -1.558253 -0.372839
O 5.446455 2.349036 0.561190
O 6.863461 0.489523 -0.791529
O 6.595065 0.253140 2.013720
O 0.439381 -1.954506 -1.805867
O -6.040586 -0.440971 1.232093
N 0.271895 1.046907 -0.010430
N -1.709887 1.921399 -0.771174
N -0.636668 -0.683341 1.539631
N -3.103094 -0.678308 1.570555
N -4.370656 0.860129 0.182395
C 3.765333 0.308932 -1.002154
C 2.320323 -0.187990 -0.862675
C 3.541890 1.843206 -1.043588
C 1.709905 0.823451 0.154270
C 4.729106 2.742934 -0.680857
C -0.744127 0.333960 0.641800
C -0.368043 1.980908 -0.844128
C -1.957135 0.890957 0.154047
C 1.186690 -2.355986 -0.890750
C 1.131232 -3.670176 -0.149936
C -3.167054 0.332505 0.656583
C 0.298613 -4.747857 -0.874943
C -1.865071 -1.121434 1.956962
C 0.176826 -6.034563 -0.032940
C -5.713199 0.505373 0.478291
C -6.732844 1.430998 -0.204834
C -8.069131 0.716024 -0.503346
C -9.149564 1.690813 -1.014714
H 4.295906 -0.081382 -1.887375
H 1.791882 -0.109563 -1.834017
H 3.219782 2.124274 -2.070185
H 1.892545 0.477179 1.186762
H 4.374486 3.763527 -0.469414
H 5.449255 2.756493 -1.520863
H 0.194877 2.695804 -1.436850
H 7.796752 0.192149 -0.645629
H 0.692352 -3.444844 0.844247
H 2.163804 -4.011571 0.049006
H 0.765080 -4.978202 -1.851970
H -0.704641 -4.341213 -1.098751
H -1.864235 -1.929476 2.694269
H -4.236800 1.629655 -0.483541
H -0.416362 -6.799956 -0.564484
H -0.322648 -5.833081 0.933189
H 1.170341 -6.469458 0.185717
H -6.922362 2.280197 0.485136
H -6.313424 1.868763 -1.132975
H -8.407505 0.211251 0.419301
H -7.896116 -0.084226 -1.248525
H -9.365029 2.474965 -0.264257
H -10.094646 1.158445 -1.225202
H -8.832921 2.195162 -1.947465


