REMARK  Name = BDB042403
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.351  -0.589  -0.311  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1       -0.797   0.117   0.122  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1       -1.741  -0.521   0.937  0.00  0.00    +0.033 A 
ATOM      4  C   LIG    1       -1.556  -1.841   1.382  0.00  0.00    -0.013 A 
ATOM      5  C   LIG    1       -0.397  -2.517   0.966  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        0.543  -1.902   0.131  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1        4.963  -1.018  -2.781  0.00  0.00    +0.105 C 
ATOM      8  N   LIG    1        4.047   0.013  -2.302  0.00  0.00    -0.302 NA
ATOM      9  C   LIG    1        2.800   0.059  -3.097  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1        1.573  -0.586  -2.413  0.00  0.00    +0.120 C 
ATOM     11  N   LIG    1        1.282   0.093  -1.129  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1        2.484   0.547  -0.383  0.00  0.00    +0.120 C 
ATOM     13  C   LIG    1        3.768  -0.167  -0.859  0.00  0.00    +0.103 C 
ENDBRANCH   1  11
BRANCH   4  14
ATOM     14  C   LIG    1       -2.541  -2.488   2.257  0.00  0.00    +0.018 A 
ATOM     15  C   LIG    1       -3.015  -3.773   2.052  0.00  0.00    +0.122 A 
ATOM     16  N   LIG    1       -3.916  -4.398   2.843  0.00  0.00    -0.243 NA
ATOM     17  C   LIG    1       -4.361  -3.685   3.887  0.00  0.00    +0.221 A 
ATOM     18  N   LIG    1       -3.991  -2.436   4.201  0.00  0.00    -0.243 NA
ATOM     19  C   LIG    1       -3.086  -1.869   3.372  0.00  0.00    +0.122 A 
ENDBRANCH   4  14
BRANCH   2  20
ATOM     20  N   LIG    1       -0.984   1.434  -0.372  0.00  0.00    -0.296 N 
ATOM     21  H   LIG    1       -0.118   1.699  -0.852  0.00  0.00    +0.154 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -1.499   2.560   0.324  0.00  0.00    +0.148 A 
ATOM     23  C   LIG    1       -1.593   3.759  -0.393  0.00  0.00    +0.102 A 
ATOM     24  C   LIG    1       -2.003   4.838   0.379  0.00  0.00    +0.155 A 
ATOM     25 CL   LIG    1       -2.096   6.426  -0.290  0.00  0.00    -0.060 Cl
ATOM     26  N   LIG    1       -2.396   4.783   1.663  0.00  0.00    -0.222 NA
ATOM     27  C   LIG    1       -2.329   3.569   2.210  0.00  0.00    +0.225 A 
ATOM     28  N   LIG    1       -1.901   2.452   1.608  0.00  0.00    -0.219 NA
BRANCH  23  29
ATOM     29  N   LIG    1       -1.088   3.875  -1.712  0.00  0.00    -0.353 N 
ATOM     30  H   LIG    1       -1.465   4.685  -2.201  0.00  0.00    +0.143 HD
ATOM     31  H   LIG    1       -1.222   3.010  -2.236  0.00  0.00    +0.143 HD
ENDBRANCH  23  29
ENDBRANCH  20  22
ENDBRANCH   2  20
TORSDOF 5