REMARK  Name = BDB018507
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.203  -1.304  -0.265  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1        1.149  -2.242  -0.682  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        1.481  -3.538  -0.842  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        2.760  -4.016  -0.611  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        3.013  -5.437  -0.787  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        3.791  -3.191  -0.180  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1        4.935  -3.560   0.069  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        3.448  -1.755  -0.028  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1        1.641   2.867   0.036  0.00  0.00    +0.214 A 
ATOM     10  N   LIG    1        1.709   2.316  -1.194  0.00  0.00    -0.221 NA
ATOM     11  C   LIG    1        1.883   0.974  -1.245  0.00  0.00    +0.123 A 
ATOM     12  C   LIG    1        2.008   0.153  -0.125  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        1.931   0.762   1.129  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        1.741   2.140   1.212  0.00  0.00    +0.068 A 
BRANCH   9  16
ATOM     15  C   LIG    1        1.420   4.913  -1.075  0.00  0.00    +0.279 C 
ATOM     16  O   LIG    1        1.464   4.230   0.174  0.00  0.00    -0.480 OA
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  17
ATOM     17  C   LIG    1       -0.193  -1.804  -0.912  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1       -1.011  -1.171  -0.005  0.00  0.00    +0.117 A 
ATOM     19  N   LIG    1       -2.176  -0.894  -0.670  0.00  0.00    -0.264 N 
ATOM     20  N   LIG    1       -2.188  -1.380  -1.934  0.00  0.00    -0.178 NA
ATOM     21  C   LIG    1       -0.974  -1.919  -2.079  0.00  0.00    +0.143 A 
BRANCH  19  22
ATOM     22  C   LIG    1       -3.362  -0.197  -0.150  0.00  0.00    +0.134 C 
ATOM     23  C   LIG    1       -4.261  -1.188   0.594  0.00  0.00    +0.038 C 
BRANCH  22  24
ATOM     24  C   LIG    1       -2.967   1.058   0.623  0.00  0.00    -0.023 A 
ATOM     25  C   LIG    1       -2.428   2.148  -0.085  0.00  0.00    +0.006 A 
ATOM     26  C   LIG    1       -2.036   3.312   0.578  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -2.172   3.407   1.960  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -2.701   2.339   2.678  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -3.096   1.172   2.017  0.00  0.00    +0.006 A 
ENDBRANCH  22  24
ENDBRANCH  19  22
ENDBRANCH   2  17
TORSDOF 5