%chk=000122274.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122274

0 1
 P    2.960500      -1.012600      -1.224600    
 P    1.292500      -2.807000      0.4073000    
 P  -0.1481000      -1.267500       2.470900    
 O   0.4098000       2.459200      -1.348700    
 O   6.3800000E-02   4.654700      0.9590000    
 O    2.223600       3.182100       1.674300    
 O    2.105900      0.3084000     -0.8465000    
 O    1.947400      -2.242000     -0.9559000    
 O    3.072100     -0.9710000      -2.838000    
 O    4.277900      -1.135400     -0.5155000    
 O   0.5876000      -1.503800       1.051600    
 O    2.564800      -3.062200       1.371300    
 O   0.3839000      -3.988900      0.2380000    
 O  -0.7351000      0.2323000       2.333500    
 O   -1.465900      -2.197900       2.375000    
 O   0.7190000      -1.505100       3.672100    
 N   -2.874300       1.892800      0.2454000    
 N   -3.664600      0.8015000      0.2009000    
 N  -0.7897000     -0.1072000      -1.691000    
 N   -2.360700      -2.037700      -1.679100    
 N   -4.494700      -2.022000     -0.5521000    
 C  -7.4699998E-02   3.236800      0.8657000    
 C    1.280800       2.555800      0.8307000    
 C  -0.6774000       2.879500     -0.4943000    
 C    1.646900       2.645900     -0.6411000    
 C   -1.697300       1.765300     -0.4260000    
 C    2.649900       1.595400      -1.084100    
 C   -1.730400      0.5048000     -0.9394000    
 C   -2.975100     -8.7399997E-02 -0.5352000    
 C   -3.292900      -1.397000     -0.9200000    
 C   -1.205400      -1.369900      -2.004400    
 H  -0.6807000       2.925800       1.721800    
 H    1.172600       1.513600       1.144500    
 H   -1.144100       3.750600     -0.9699000    
 H    2.038200       3.639700     -0.8915000    
 H    3.594200       1.698500     -0.5406000    
 H    2.841600       1.691500      -2.157500    
 H   0.4506000       4.850400       1.829400    
 H    2.375000       4.083900       1.344300    
 H   -3.209400       2.697800      0.7595000    
 H  -0.5094000      -1.941300      -2.611900    
 H   -4.673300      -2.969200     -0.8565000    
 H   -5.173200      -1.529000      1.2500000E-02
 H    3.752500     -0.3989000      -3.252500    
 H    3.109400      -3.866600       1.235700    
 H   -1.156800      0.6517000       3.113400    
 H   -2.046100      -2.282500       3.161400    


%chk=000122274-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122274

0 1
P 3.703179 -1.348152 -0.903821
P 3.160527 -2.836408 1.974458
P 3.167395 0.007442 3.409619
O 0.394165 1.959951 -1.077368
O -1.982851 0.823319 1.460265
O 0.208817 1.511130 2.397573
O 2.348949 -0.324086 -0.681248
O 3.559886 -2.604929 0.319538
O 3.170299 -2.336069 -2.186471
O 5.111537 -0.652878 -1.037072
O 2.443351 -1.402042 2.491340
O 4.671046 -2.640228 2.823208
O 2.410569 -4.202541 2.194505
O 1.809553 0.652700 4.068414
O 3.949165 -0.757184 4.702608
O 4.045644 0.854593 2.393684
N -1.919043 2.094359 -2.929856
N -3.089970 1.899465 -3.655959
N -4.001995 0.971406 -0.236311
N -5.996592 0.687438 -1.626158
N -6.048396 1.135140 -3.935895
C -0.970599 0.715453 0.433022
C 0.429949 0.827483 1.097921
C -0.966482 1.936448 -0.534958
C 1.270390 1.705564 0.118589
C -2.013560 1.809400 -1.586047
C 2.588887 1.123504 -0.361993
C -3.349085 1.396465 -1.389738
C -3.968248 1.475267 -2.681379
C -5.356891 1.097381 -2.761406
C -5.298876 0.641492 -0.441814
H -1.047502 -0.223792 -0.144492
H 0.889616 -0.154212 1.290128
H -1.149613 2.847339 0.081404
H 1.476523 2.677205 0.613295
H 3.354139 1.210376 0.431245
H 2.918719 1.635553 -1.281710
H -2.925235 0.841750 0.992000
H -0.800903 1.436354 2.538418
H -1.072362 2.383931 -3.420981
H -5.867273 0.295990 0.425857
H -7.027745 0.852680 -3.938722
H -5.590472 1.432174 -4.795725
H 3.062913 -3.289721 -1.933256
H 5.402899 -3.261264 2.584806
H 1.069261 1.084180 3.377551
H 4.567516 -1.473526 4.364832


