%chk=000167974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167974

0 1
 P   -2.070200       2.491400      0.7469000    
 P   -3.682900      0.2617000     -0.2982000    
 P   -2.205400      -1.192900      -2.397200    
 O    2.122000       1.478400       1.048000    
 O    4.292000       1.004500      -1.767200    
 O    4.044600       3.314400     -0.3384000    
 O  -0.4673000       2.570000      0.9537000    
 O    4.204700      -1.850400     -0.9602000    
 O   -2.320800       1.050400      6.1000001E-02
 O   -2.659200       2.297500       2.241100    
 O  -1.2000000E-02  -4.407900      0.9744000    
 O   -2.665400       3.644000     -8.7000001E-03
 O   -3.160800      -1.038500      -1.102800    
 O   -4.363400       1.169000      -1.450100    
 O   -4.572400     -4.3099999E-02  0.8709000    
 O  -0.7768000     -0.6576000      -1.863200    
 O   -1.987500      -2.789600      -2.519700    
 O   -2.716600     -0.5183000      -3.636000    
 N    2.518600     -0.6948000      0.2837000    
 N    2.283700      -2.913000     -5.4900002E-02
 N   0.3874000     -0.4645000       1.592200    
 N  -0.8645000      -2.466900       1.902000    
 N   -1.589800     -0.4028000       2.776400    
 C    3.013200      0.6524000      0.2812000    
 C    3.063200       1.249700      -1.114600    
 C    2.844700       2.721500     -0.8345000    
 C    1.834900       2.683000      0.3044000    
 C   0.3908000       2.612400     -0.1737000    
 C    1.347700      -1.122700      0.8832000    
 C    3.156100      -1.820000     -0.3346000    
 C    1.230000      -2.439700      0.6694000    
 C   7.6899998E-02  -3.202800       1.185400    
 C  -0.6955000      -1.174600       2.080100    
 H    4.001200      0.6436000      0.7566000    
 H    2.251400      0.8570000      -1.739200    
 H    2.525500       3.295700      -1.708100    
 H    1.957100       3.520700       1.000300    
 H   0.2118000       1.712800     -0.7693000    
 H   0.1414000       3.491600     -0.7763000    
 H    4.285600       1.506600      -2.599800    
 H    4.292000       2.879300      0.4944000    
 H    2.412400      -3.876300     -0.3385000    
 H   0.4974000      0.5284000       1.754300    
 H   -2.427900     -0.8056000       3.181000    
 H   -1.433500      0.5890000       2.918000    
 H   -2.748800       3.083200       2.821300    
 H   -4.838700       1.987000      -1.190800    
 H  -3.5500001E-02 -0.5633000      -2.498600    
 H   -1.493600      -3.143900      -3.289500    


%chk=000167974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167974

0 1
P -1.845257 2.759087 0.330340
P -3.469008 0.289471 -0.659758
P -3.632919 -2.787199 -1.470751
O 2.315690 1.699977 1.388612
O 5.131459 1.643572 -0.902353
O 4.484408 3.723210 0.658478
O -0.205290 2.502905 0.813687
O 4.475177 -1.100265 -1.122585
O -2.095433 1.375808 -0.753582
O -2.610708 2.285554 1.764070
O -0.223309 -3.867176 -0.542278
O -2.131086 4.154254 -0.350454
O -2.756601 -1.183653 -0.814656
O -4.327660 0.428069 -2.138118
O -4.321936 0.733076 0.632412
O -3.490914 -2.409517 -3.142729
O -2.552600 -3.928091 -1.172866
O -5.098525 -2.738618 -0.870463
N 2.689601 -0.371948 0.301029
N 2.478913 -2.385078 -0.670806
N 0.480241 -0.339507 1.465114
N -0.860443 -2.305175 1.091985
N -1.676539 -0.561742 2.418203
C 3.313017 0.918630 0.667356
C 3.724946 1.742379 -0.592161
C 3.404457 3.199002 -0.159110
C 2.154924 3.037939 0.728181
C 0.848497 3.065288 -0.074908
C 1.478719 -0.909180 0.710156
C 3.349635 -1.297507 -0.576078
C 1.326969 -2.164785 0.110783
C 0.063451 -2.826400 0.220575
C -0.682383 -1.095479 1.651949
H 4.188841 0.738689 1.318337
H 3.092749 1.442806 -1.452596
H 3.218889 3.847292 -1.039667
H 2.139664 3.776028 1.544523
H 0.904504 2.440532 -0.986635
H 0.588198 4.103319 -0.354114
H 5.311107 0.685451 -1.134655
H 5.334833 3.368589 0.278536
H 2.648380 -3.204109 -1.252912
H 0.562942 0.661113 1.713419
H -2.541968 -1.098542 2.477443
H -1.671716 0.409886 2.737123
H -3.478642 1.739577 1.546531
H -5.083253 1.070292 -2.138675
H -4.014857 -1.602091 -3.397707
H -1.341363 -3.959733 -0.782423


