REMARK  Name = BDB032387
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.375  -1.756   0.060  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -0.704  -2.212  -1.083  0.00  0.00    +0.005 A 
ATOM      3  C   LIG    1        0.672  -2.452  -1.050  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1        1.407  -2.227   0.121  0.00  0.00    -0.022 A 
ATOM      5  C   LIG    1        0.735  -1.772   1.264  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1       -0.639  -1.532   1.232  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1       -2.860  -1.482   0.028  0.00  0.00    +0.136 C 
BRANCH   7   8
ATOM      8  N   LIG    1       -3.081  -0.043  -0.000  0.00  0.00    -0.340 N 
ATOM      9  H   LIG    1       -2.381   0.441  -0.558  0.00  0.00    +0.146 HD
BRANCH   8  14
ATOM     10  C   LIG    1       -8.248   2.170  -0.658  0.00  0.00    +0.124 A 
ATOM     11  C   LIG    1       -6.943   1.649  -0.519  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1       -6.818   0.313  -0.091  0.00  0.00    -0.011 A 
ATOM     13  C   LIG    1       -5.537  -0.255   0.073  0.00  0.00    +0.031 A 
ATOM     14  C   LIG    1       -4.367   0.460  -0.213  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1       -4.504   1.795  -0.606  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1       -7.977  -0.426   0.165  0.00  0.00    +0.028 A 
ATOM     17  C   LIG    1       -9.207   0.179  -0.021  0.00  0.00    +0.113 A 
ATOM     18  C   LIG    1       -5.764   2.379  -0.774  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1       -9.366   1.455  -0.426  0.00  0.00    -0.240 NA
BRANCH  10  20
ATOM     20  N   LIG    1       -8.477   3.490  -1.060  0.00  0.00    -0.343 N 
ATOM     21  H   LIG    1       -9.487   3.616  -1.042  0.00  0.00    +0.144 HD
ATOM     22  H   LIG    1       -8.014   4.136  -0.431  0.00  0.00    +0.144 HD
ENDBRANCH  10  20
ENDBRANCH   8  14
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   4  23
ATOM     23  C   LIG    1        2.890  -2.507   0.161  0.00  0.00    +0.195 C 
BRANCH  23  24
ATOM     24  O   LIG    1        3.604  -1.473   0.841  0.00  0.00    -0.372 OA
BRANCH  24  25
ATOM     25  C   LIG    1        3.873  -0.318   0.034  0.00  0.00    +0.121 C 
ATOM     26  C   LIG    1        3.988   0.886   0.972  0.00  0.00    +0.047 C 
ATOM     27  C   LIG    1        5.271   0.840   1.807  0.00  0.00    +0.087 C 
ATOM     28  N   LIG    1        6.497   0.675   1.010  0.00  0.00    -0.297 NA
ATOM     29  C   LIG    1        6.391  -0.516   0.158  0.00  0.00    +0.087 C 
ATOM     30  C   LIG    1        5.168  -0.504  -0.761  0.00  0.00    +0.047 C 
BRANCH  28  31
ATOM     31  C   LIG    1        6.873   1.914   0.292  0.00  0.00    +0.156 C 
BRANCH  31  32
ATOM     32  C   LIG    1        8.158   1.890  -0.559  0.00  0.00    +0.355 C 
ATOM     33  F   LIG    1        9.180   1.293   0.100  0.00  0.00    -0.208 F 
ATOM     34  F   LIG    1        7.956   1.192  -1.706  0.00  0.00    -0.208 F 
ENDBRANCH  31  32
ENDBRANCH  28  31
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   4  23
TORSDOF 9