REMARK  Name = BDB001878
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.091   0.119  -1.363  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   7
ATOM      2  C   LIG    1       -4.663  -0.232  -0.044  0.00  0.00    +0.164 A 
ATOM      3  C   LIG    1       -5.212  -1.112  -0.994  0.00  0.00    +0.180 A 
ATOM      4  C   LIG    1       -4.438  -1.568  -2.068  0.00  0.00    +0.086 A 
ATOM      5 CL   LIG    1       -5.092  -2.625  -3.268  0.00  0.00    -0.080 Cl
ATOM      6  C   LIG    1       -3.103  -1.180  -2.187  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1       -2.535  -0.315  -1.244  0.00  0.00    -0.025 A 
ATOM      8  C   LIG    1       -3.326   0.153  -0.177  0.00  0.00    +0.054 A 
BRANCH   3   9
ATOM      9  O   LIG    1       -6.538  -1.475  -0.917  0.00  0.00    -0.490 OA
ATOM     10  C   LIG    1       -6.706  -2.543   0.015  0.00  0.00    +0.277 C 
ENDBRANCH   3   9
BRANCH   2  11
ATOM     11  O   LIG    1       -5.510   0.193   0.945  0.00  0.00    -0.489 OA
BRANCH  11  13
ATOM     12  C   LIG    1       -5.080   2.481   1.629  0.00  0.00    +0.048 C 
ATOM     13  C   LIG    1       -5.010   1.010   2.001  0.00  0.00    +0.226 C 
ENDBRANCH  11  13
ENDBRANCH   2  11
ENDBRANCH   1   7
BRANCH   1  14
ATOM     14  N   LIG    1       -0.338  -0.425  -0.242  0.00  0.00    -0.340 N 
ATOM     15  H   LIG    1       -0.582  -1.393  -0.047  0.00  0.00    +0.146 HD
BRANCH  14  16
ATOM     16  C   LIG    1        1.044  -0.227  -0.183  0.00  0.00    +0.027 A 
ATOM     17  C   LIG    1        1.712   0.815  -0.824  0.00  0.00    +0.025 A 
ATOM     18  C   LIG    1        3.096   1.000  -0.667  0.00  0.00    +0.025 A 
ATOM     19  C   LIG    1        3.874   0.175   0.156  0.00  0.00    +0.030 A 
ATOM     20  C   LIG    1        3.182  -0.838   0.830  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1        1.799  -1.027   0.676  0.00  0.00    +0.025 A 
BRANCH  19  22
ATOM     22  N   LIG    1        5.227   0.357   0.304  0.00  0.00    -0.330 N 
ATOM     23  C   LIG    1        6.104  -0.553   1.036  0.00  0.00    +0.105 C 
ATOM     24  C   LIG    1        7.510  -0.106   0.643  0.00  0.00    +0.020 C 
ATOM     25  C   LIG    1        7.342   1.385   0.407  0.00  0.00    +0.020 C 
ATOM     26  C   LIG    1        5.975   1.474  -0.269  0.00  0.00    +0.105 C 
ENDBRANCH  19  22
ENDBRANCH  14  16
ENDBRANCH   1  14
TORSDOF 7