REMARK  Name = BDB054423
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.222   0.334  -1.075  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1        0.053  -0.342  -1.096  0.00  0.00    -0.231 NA
ATOM      3  C   LIG    1       -1.064   0.339  -1.411  0.00  0.00    +0.120 A 
ATOM      4  C   LIG    1       -1.039   1.690  -1.736  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1        0.174   2.371  -1.721  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        1.332   1.682  -1.385  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1  15
ATOM      7 CL   LIG    1        4.402   2.029   3.347  0.00  0.00    -0.082 Cl
ATOM      8  C   LIG    1        4.304   0.806   2.144  0.00  0.00    +0.058 A 
ATOM      9  C   LIG    1        3.303   0.781   1.250  0.00  0.00    +0.113 A 
ATOM     10  N   LIG    1        3.269  -0.237   0.293  0.00  0.00    -0.297 N 
ATOM     11  C   LIG    1        4.222  -1.255   0.241  0.00  0.00    +0.138 A 
ATOM     12  N   LIG    1        3.953  -2.126  -0.705  0.00  0.00    -0.235 NA
ATOM     13  C   LIG    1        2.798  -1.675  -1.286  0.00  0.00    +0.141 A 
ATOM     14  C   LIG    1        5.286  -1.211   1.187  0.00  0.00    +0.048 A 
ATOM     15  C   LIG    1        2.371  -0.482  -0.731  0.00  0.00    +0.092 A 
ATOM     16  C   LIG    1        5.329  -0.222   2.101  0.00  0.00    +0.025 A 
ENDBRANCH   1  15
BRANCH   3  17
ATOM     17  N   LIG    1       -2.237  -0.410  -1.424  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1       -1.954  -1.352  -1.149  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -3.333   0.077  -0.581  0.00  0.00    +0.087 C 
ATOM     20  C   LIG    1       -4.583  -0.813  -0.748  0.00  0.00    +0.103 C 
ATOM     21  N   LIG    1       -4.780  -1.484   0.543  0.00  0.00    -0.314 NA
ATOM     22  H   LIG    1       -5.763  -1.702   0.694  0.00  0.00    +0.122 HD
ATOM     23  C   LIG    1       -4.283  -0.543   1.540  0.00  0.00    +0.083 C 
ATOM     24  C   LIG    1       -3.004  -0.025   0.911  0.00  0.00    +0.038 C 
ENDBRANCH  17  19
ENDBRANCH   3  17
TORSDOF 3