%chk=000000508.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000508

0 1
 P   -2.633400      -2.518700      -1.333200    
 P   -4.337800     -0.9182000      0.4506000    
 P   -3.486200       1.905700      0.3688000    
 P   -1.375900       2.554600      -1.574400    
 O   0.6003000     -7.6800004E-02  0.1766000    
 O   0.3189000      0.9332000       3.280100    
 O    1.626400      -2.174000       2.072900    
 O   -1.174500      -1.876200      -1.055600    
 O   -3.475500      -2.212900      1.2700000E-02
 O   -2.390300      -4.116600      -1.264100    
 O   -3.299200      -2.047000      -2.593400    
 O   -3.364500      0.3192000      9.5700003E-02
 O   -4.297900     -0.9849000       2.065500    
 O   -5.712200     -0.8500000     -0.1469000    
 O   -2.058600       2.484500     -0.1133000    
 O   -3.416000       2.013900       1.980500    
 O   -4.685800       2.555300     -0.2557000    
 O   -2.318500       3.592000      -2.378900    
 O  -2.5000000E-02   3.404800      -1.315100    
 O   -1.165500       1.228900      -2.244300    
 N    2.718800      0.8795000      0.6437000    
 N    4.718400       1.797300      0.2846000    
 N    3.076300      -1.304000     -0.3588000    
 N    5.335600      -1.506800      -1.259000    
 N    6.935200      0.2684000      -1.127300    
 C    1.198800      0.1354000       2.491400    
 C   0.5796000      -1.226200       2.237900    
 C    1.332100      0.7530000       1.096500    
 C  -0.1885000      -1.004600      0.9397000    
 C  -0.4467000      -2.244400      0.1036000    
 C    3.459200     -6.8300001E-02 -3.5999999E-03
 C    3.518000       1.981900      0.7933000    
 C    4.695600      0.5201000     -0.2167000    
 C    5.653400     -0.2482000     -0.8708000    
 C    4.085300      -1.949900     -0.9829000    
 H    2.157000      8.7099999E-02   3.020300    
 H  -8.2500003E-02  -1.576100       3.036100    
 H   0.8968000       1.758300       1.050200    
 H   -1.133400     -0.4929000       1.153600    
 H   0.4900000      -2.690400     -0.2439000    
 H  -0.9891000      -2.995000      0.6876000    
 H   0.2181000      0.4908000       4.140200    
 H    2.094700      -2.243400       2.922300    
 H    3.173600       2.884400       1.279500    
 H    3.865400      -2.961400      -1.307300    
 H    7.175100       1.206900     -0.8376000    
 H    7.614200     -0.3098000      -1.603200    
 H   -3.116700      -4.718700      -1.532500    
 H   -4.885100      -1.619200       2.529100    
 H   -4.214800       1.794400       2.505800    
 H   -2.152200       3.742300      -3.333800    
 H   0.6179000       3.509800      -2.048400    


%chk=000000508-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000000508

0 1
P -3.242395 -2.611376 -1.051961
P -4.377647 -0.046993 0.522856
P -2.509733 2.484604 0.288582
P -0.759796 1.966844 -2.356098
O 0.153233 -0.463231 0.230100
O 0.044499 -0.335778 3.489629
O 1.819513 -2.820096 1.311251
O -1.586815 -2.342166 -1.305884
O -3.669630 -1.589280 0.332528
O -3.194442 -4.100800 -0.199721
O -4.185024 -2.453802 -2.299687
O -3.236248 0.948800 -0.257975
O -3.875724 0.324710 2.159107
O -5.923496 0.080268 0.259424
O -1.139692 2.507583 -0.682514
O -1.780741 2.021341 1.765403
O -3.482192 3.720550 0.291752
O 0.451709 3.113658 -2.730460
O 0.167942 0.635893 -2.043345
O -2.015188 1.942919 -3.312278
N 2.030636 0.911217 0.786667
N 3.414912 2.574381 0.012282
N 3.514618 -1.049967 0.347410
N 5.654091 -0.400421 -0.642119
N 6.200664 1.844369 -1.128246
C 1.027252 -0.732662 2.469014
C 0.683446 -2.129478 1.855665
C 0.828355 0.301140 1.322451
C -0.380189 -1.741189 0.791765
C -0.535035 -2.759929 -0.323346
C 3.200849 0.278232 0.352008
C 2.217060 2.294075 0.538998
C 4.041351 1.319157 -0.113354
C 5.312333 0.936874 -0.634165
C 4.761850 -1.304380 -0.161685
H 2.057580 -0.725251 2.871208
H 0.235841 -2.786001 2.624657
H 0.144289 1.099162 1.663333
H -1.348387 -1.519354 1.278953
H 0.373682 -2.827155 -0.938221
H -0.781273 -3.750724 0.094417
H 0.172328 -0.892947 4.297791
H 2.503258 -2.153114 0.880359
H 1.430568 3.015432 0.749991
H 5.068754 -2.353309 -0.188067
H 5.955984 2.832904 -1.151598
H 7.088418 1.515694 -1.503986
H -4.073564 -4.494103 0.030448
H -4.538967 0.115448 2.863415
H -2.388139 1.438600 2.320633
H 0.113399 3.904484 -3.225047
H 0.084804 0.122268 -1.134239


