REMARK  Name = BDB062404
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.718  -1.269  -0.231  0.00  0.00    +0.125 A 
ATOM      2  C   LIG    1        0.193  -0.148   0.436  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -1.170   0.171   0.282  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1       -2.022  -0.613  -0.506  0.00  0.00    +0.002 A 
ATOM      5  C   LIG    1       -1.486  -1.732  -1.149  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -0.129  -2.058  -1.014  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.425  -0.238  -0.629  0.00  0.00    +0.089 A 
ATOM      8  N   LIG    1       -3.977   0.838   0.064  0.00  0.00    -0.232 NA
ATOM      9  C   LIG    1       -5.229   0.853  -0.310  0.00  0.00    +0.110 A 
ATOM     10  C   LIG    1       -6.425   1.671  -0.040  0.00  0.00    +0.076 C 
ATOM     11  C   LIG    1       -7.365   1.233  -1.193  0.00  0.00    +0.029 C 
ATOM     12  C   LIG    1       -6.871  -0.157  -1.640  0.00  0.00    +0.123 C 
ATOM     13  N   LIG    1       -5.498  -0.147  -1.188  0.00  0.00    -0.334 N 
ATOM     14  C   LIG    1       -4.383  -0.859  -1.423  0.00  0.00    +0.115 A 
ENDBRANCH   4   7
BRANCH   1  16
ATOM     15  C   LIG    1        2.659  -2.501  -0.864  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1        2.053  -1.511  -0.042  0.00  0.00    -0.495 OA
ENDBRANCH   1  16
BRANCH   2  17
ATOM     17  C   LIG    1        1.067   0.751   1.270  0.00  0.00    +0.143 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.627   1.819   0.468  0.00  0.00    -0.311 N 
ATOM     19  H   LIG    1        1.074   2.164  -0.307  0.00  0.00    +0.149 HD
ATOM     20  C   LIG    1        2.779   2.513   0.678  0.00  0.00    +0.218 C 
ATOM     21  O   LIG    1        3.069   3.441  -0.079  0.00  0.00    -0.275 OA
BRANCH  20  22
ATOM     22  C   LIG    1        3.689   2.119   1.829  0.00  0.00    +0.131 C 
BRANCH  22  23
ATOM     23  C   LIG    1        4.574   0.927   1.537  0.00  0.00    -0.037 A 
ATOM     24  C   LIG    1        5.260   0.812   0.317  0.00  0.00    +0.025 A 
ATOM     25  C   LIG    1        6.077  -0.295   0.058  0.00  0.00    +0.060 A 
ATOM     26 CL   LIG    1        6.861  -0.376  -1.481  0.00  0.00    -0.082 Cl
ATOM     27  C   LIG    1        6.231  -1.290   1.028  0.00  0.00    +0.059 A 
ATOM     28 CL   LIG    1        7.212  -2.690   0.776  0.00  0.00    -0.082 Cl
ATOM     29  C   LIG    1        5.572  -1.170   2.254  0.00  0.00    +0.022 A 
ATOM     30  C   LIG    1        4.755  -0.066   2.509  0.00  0.00    +0.005 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH  17  18
ENDBRANCH   2  17
TORSDOF 6