REMARK  Name = BDB009127
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.162   1.116  -0.746  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        1.794   2.260  -0.235  0.00  0.00    +0.131 A 
ATOM      3  F   LIG    1        3.135   2.335  -0.204  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.067   3.346   0.249  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -0.325   3.311   0.233  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1       -0.994   2.189  -0.271  0.00  0.00    -0.046 A 
ATOM      7  C   LIG    1       -0.245   1.101  -0.752  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  10
ATOM      8  C   LIG    1        3.701  -1.689  -0.980  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        2.952  -0.613  -0.484  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        1.932  -0.033  -1.254  0.00  0.00    -0.014 A 
ATOM     11  C   LIG    1        1.668  -0.584  -2.521  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        2.392  -1.680  -3.002  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        3.406  -2.239  -2.228  0.00  0.00    +0.013 A 
BRANCH   8  15
ATOM     14  O   LIG    1        4.736  -3.514   0.013  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        4.771  -2.298  -0.160  0.00  0.00    +0.247 C 
ATOM     16  N   LIG    1        5.745  -1.468   0.398  0.00  0.00    -0.293 N 
ATOM     17  C   LIG    1        6.781  -2.115   1.205  0.00  0.00    +0.136 C 
ATOM     18  C   LIG    1        7.467  -1.117   2.141  0.00  0.00    +0.179 C 
ATOM     19  O   LIG    1        7.969   0.017   1.417  0.00  0.00    -0.377 OA
ATOM     20  C   LIG    1        6.897   0.698   0.749  0.00  0.00    +0.179 C 
ATOM     21  C   LIG    1        6.194  -0.226  -0.249  0.00  0.00    +0.136 C 
ENDBRANCH   8  15
ENDBRANCH   1  10
BRANCH   6  22
ATOM     22  C   LIG    1       -2.501   2.133  -0.262  0.00  0.00    +0.041 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.035   1.623   1.074  0.00  0.00    +0.062 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.549   1.503   1.010  0.00  0.00    +0.065 A 
ATOM     25  C   LIG    1       -5.174   0.208   0.598  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1       -4.334  -1.011   0.341  0.00  0.00    +0.037 C 
ATOM     27  C   LIG    1       -5.151  -2.298   0.184  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -6.406  -2.063  -0.646  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -7.292  -0.993  -0.005  0.00  0.00    +0.041 C 
ATOM     30  C   LIG    1       -6.512   0.203   0.465  0.00  0.00    +0.023 A 
ATOM     31  C   LIG    1       -7.297   1.423   0.782  0.00  0.00    +0.268 A 
ATOM     32  O   LIG    1       -8.520   1.446   0.691  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -6.574   2.512   1.186  0.00  0.00    -0.243 N 
ATOM     34  H   LIG    1       -7.091   3.357   1.404  0.00  0.00    +0.192 HD
ATOM     35  N   LIG    1       -5.220   2.580   1.284  0.00  0.00    -0.176 NA
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 5