%chk=000065800.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065800

0 1
 P  -0.7028000       1.038100      -1.109400    
 P   -1.513500      -1.247900      0.1392000    
 P   0.5805000      0.2025000       1.148300    
 O    4.756800     -0.8084000     -0.1105000    
 N   -2.031000       1.969700      -1.399300    
 N   0.4341000       1.382200      -2.251900    
 N   -1.701500      -2.856000     -0.1717000    
 N   -2.943200     -0.6557000      0.7060000    
 N   0.9265000      0.7313000       2.670900    
 N   -1.108800     -0.5099000      -1.226600    
 N  -0.1198000       1.399100      0.3413000    
 N  -0.3801000      -1.076100       1.260200    
 N    2.001600     -0.2342000      0.4093000    
 C   -2.589100       2.682900     -0.2574000    
 C   -1.838100       3.412600      -1.332500    
 C    1.012900      0.2466000      -2.958600    
 C   4.4100001E-02   1.168600      -3.639600    
 C   -2.154400      -3.212600      -1.510300    
 C  -0.7366000      -3.457300      -1.083300    
 C   -2.970100     -0.2444000       2.103900    
 C   -3.663500      -1.496800       1.653200    
 C    1.181300       2.158100       2.823400    
 C  -9.3199998E-02   1.542800       3.322900    
 C    2.654700      -1.452100      0.9076000    
 C    3.000800      0.8272000      0.2268000    
 C    3.806700      -1.867000      3.9999999E-04
 C    4.145600      0.3568000     -0.6622000    
 H   -3.668100       2.769800     -0.2487000    
 H   -2.137200       2.603500      0.7189000    
 H  -0.8485000       3.783500      -1.104100    
 H   -2.406900       3.993900      -2.045100    
 H    2.056100      0.3431000      -3.229400    
 H   0.6966000     -0.7614000      -2.741100    
 H  -0.9539000      0.8030000      -3.838500    
 H   0.4355000       1.883100      -4.350400    
 H   -2.359900      -2.426000      -2.221500    
 H   -2.819800      -4.064300      -1.564000    
 H  -0.4459000      -4.472900     -0.8498000    
 H   4.9100000E-02  -2.832100      -1.481800    
 H   -3.580900      0.6216000       2.322000    
 H   -2.120100     -0.3841000       2.753000    
 H   -3.232000      -2.440400       1.956600    
 H   -4.741400      -1.478000       1.569600    
 H    1.936200       2.419300       3.553600    
 H    1.147000       2.797600       1.953700    
 H   -1.004500       1.768900       2.790000    
 H  -0.1999000       1.390600       4.388200    
 H    3.025900      -1.277300       1.924700    
 H    1.937000      -2.277600      0.9525000    
 H    2.543300       1.712400     -0.2257000    
 H    3.401800       1.124000       1.203400    
 H    4.322200      -2.734500      0.4246000    
 H    3.451900      -2.148000     -0.9988000    
 H    3.811000      0.1428000      -1.682600    
 H    4.912000       1.136000     -0.7241000    


%chk=000065800-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065800

0 1
P -0.770094 1.316222 -1.203193
P -1.533448 -1.257653 0.098667
P 0.624687 0.367460 1.203196
O 4.591469 -1.553926 -0.133017
N -2.017996 2.579755 -1.361085
N 0.092771 1.664060 -2.716018
N -1.228156 -2.941092 -0.391597
N -3.208970 -1.476848 0.645631
N 0.909669 1.040384 2.829610
N -1.497414 -0.228769 -1.272602
N 0.270323 1.654057 0.121920
N -0.532124 -0.866571 1.440728
N 2.151175 -0.331507 0.725275
C -2.716274 3.047260 -0.105597
C -1.711508 3.953491 -0.796491
C 0.773536 0.532320 -3.451592
C -0.498724 1.146428 -4.010847
C -1.558015 -3.338576 -1.817121
C -0.110962 -3.208653 -1.373294
C -3.740191 -0.560796 1.724360
C -3.431864 -2.013097 2.046122
C 1.424230 2.465353 2.927036
C 0.006011 2.128190 3.356112
C 2.679588 -1.503203 1.463118
C 3.201460 0.496187 0.090464
C 3.520720 -2.351521 0.492680
C 4.019084 -0.403041 -0.853030
H -3.789591 3.218126 -0.227987
H -2.411063 2.604724 0.852189
H -0.740097 4.088995 -0.306189
H -2.056279 4.777654 -1.427821
H 1.746035 0.795390 -3.878560
H 0.687306 -0.478675 -3.034754
H -1.414256 0.547352 -3.942439
H -0.449986 1.861305 -4.837398
H -1.952712 -2.555176 -2.474843
H -2.020204 -4.326103 -1.905115
H 0.477126 -4.103728 -1.148959
H 0.456424 -2.350944 -1.755473
H -4.773154 -0.237832 1.565239
H -3.058735 0.187329 2.150503
H -2.544018 -2.206776 2.659414
H -4.239488 -2.747961 2.113002
H 2.206821 2.608934 3.678081
H 1.531290 3.029699 1.992292
H -0.802450 2.488383 2.707103
H -0.241427 2.030404 4.417239
H 3.308769 -1.177166 2.318923
H 1.831840 -2.094584 1.853507
H 2.719457 1.314817 -0.473781
H 3.880290 0.935418 0.855266
H 4.037627 -3.168881 1.022472
H 2.861086 -2.773074 -0.296852
H 3.363459 -0.764834 -1.676080
H 4.883448 0.137890 -1.273113


