%chk=000162679.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162679

0 1
 P    4.448500      0.4476000     -0.9506000    
 O  -0.3305000       1.959000      -1.152600    
 O  -0.9577000       1.533400       2.361100    
 O   0.4541000       3.597100       1.296700    
 O    3.235200       1.450600     -0.5746000    
 O    3.859000      -1.000800     -0.5362000    
 O    4.427700      0.4087000      -2.568300    
 O    5.778100      0.7833000     -0.3395000    
 O    3.740400     -0.6751000       1.723300    
 O    1.084300      -2.212600     -0.5542000    
 N   -2.081400      0.5251000     -0.4396000    
 N   -2.757200      -1.351500      -1.439600    
 N   -4.093700       1.079900      0.8034000    
 N   -5.853600     -0.5682000      0.4258000    
 N   -5.552800      -2.464500      -1.002800    
 N    3.474100      -3.432200       1.992200    
 C  -0.3012000       1.321200       1.128000    
 C   0.8448000       2.285100      0.8918000    
 C   -1.204800       1.629400     -5.6200001E-02
 C   0.9831000       2.259900     -0.6271000    
 C    1.952000       1.192900      -1.117200    
 C   -3.369100      0.3183000     -2.9899999E-02
 C   -1.760600     -0.5048000      -1.285700    
 C   -3.768800     -0.8492000     -0.6603000    
 C   -5.064300      -1.288900     -0.4069000    
 C   -5.326900      0.5549000      0.9711000    
 C    3.579100      -1.384700      0.7400000    
 C    3.043700      -2.805300      0.7434000    
 C    1.518400      -2.808800      0.6643000    
 H   5.6400001E-02  0.2853000       1.091600    
 H    1.749200       2.028800       1.448900    
 H   -1.854700       2.493300      0.1291000    
 H    1.287900       3.240400      -1.011000    
 H    1.996100       1.209600      -2.211400    
 H    1.609800      0.2004000     -0.8228000    
 H  -0.2943000       1.433000       3.064800    
 H  -0.2620000       3.908100      0.7184000    
 H  -0.7944000     -0.5871000      -1.763500    
 H   -5.986300       1.106700       1.632400    
 H   -6.497700      -2.763200     -0.8030000    
 H   -4.965900      -3.003900      -1.624700    
 H    4.809300       1.163200      -3.065500    
 H    3.486800      -3.348200     -9.8999999E-02
 H    1.072900      -2.232900       1.483100    
 H    1.117200      -3.827100      0.7064000    
 H    3.034300      -2.964800       2.784900    
 H    3.142200      -4.395800       2.020300    
 H    1.474900      -2.722500      -1.284200    


%chk=000162679-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162679

0 1
P 4.566827 0.736592 -1.162638
O -0.523024 1.737671 -1.005690
O -0.782637 1.401578 2.617975
O 0.514200 3.465258 1.434981
O 3.181695 1.693002 -0.920319
O 4.087708 -0.930108 -0.678215
O 4.565142 0.389002 -2.848349
O 5.907714 1.305084 -0.558335
O 3.318854 -0.443659 1.486213
O 1.161034 -2.191967 -0.493718
N -2.191650 0.303744 -0.059358
N -2.972609 -1.776510 -0.638654
N -4.361276 1.509219 0.126569
N -6.276970 0.038083 -0.345973
N -6.036506 -2.244697 -0.910209
N 3.807465 -3.389058 1.896320
C -0.213481 1.124495 1.296501
C 0.898241 2.146957 0.932901
C -1.290699 1.404939 0.222283
C 0.844936 2.195262 -0.604191
C 1.812083 1.232402 -1.306088
C -3.590840 0.412137 -0.113593
C -1.880224 -1.031407 -0.390538
C -4.050653 -0.883423 -0.465579
C -5.462337 -1.045817 -0.578360
C -5.692481 1.231153 -0.013653
C 3.562758 -1.263431 0.579408
C 3.308724 -2.788367 0.663739
C 1.771830 -3.004526 0.571781
H 0.166044 0.088321 1.219686
H 1.893385 1.852477 1.312937
H -1.918757 2.264182 0.522611
H 0.991157 3.231640 -0.949119
H 1.704317 1.302560 -2.401499
H 1.644081 0.190497 -0.977035
H -0.353296 0.832102 3.302477
H 0.014615 3.316282 2.284759
H -0.855104 -1.400740 -0.444579
H -6.380466 2.063648 0.160547
H -7.050113 -2.302571 -0.980340
H -5.448817 -3.055182 -1.091532
H 5.409520 0.625222 -3.310824
H 3.803761 -3.262679 -0.200086
H 1.294625 -2.657054 1.503355
H 1.564692 -4.082190 0.442146
H 3.519714 -2.908634 2.753902
H 4.794322 -3.654267 1.894160
H 1.404099 -2.554119 -1.382177


