REMARK  Name = BDB024711
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.460  -3.050  -0.661  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        5.103  -1.790  -0.146  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        6.143  -0.745  -0.044  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        6.263   0.039  -1.357  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        5.931   0.157   1.168  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        4.581   0.831   1.100  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        3.489  -0.163   0.824  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        2.156   0.178   1.151  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1        1.675   1.333   1.720  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        0.369   1.176   1.835  0.00  0.00    +0.115 A 
ATOM     11  N   LIG    1       -0.013  -0.052   1.337  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1        1.120  -0.707   0.903  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        1.333  -1.954   0.324  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        2.656  -2.283  -0.010  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        3.747  -1.426   0.222  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        4.747  -4.043  -0.742  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1        7.183  -4.342  -1.619  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1        6.762  -3.085  -1.088  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1       -1.359  -0.597   1.272  0.00  0.00    +0.139 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.986  -0.434  -0.122  0.00  0.00    +0.106 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.296  -1.100  -0.269  0.00  0.00    -0.296 NA
ATOM     22  C   LIG    1       -3.789  -0.999  -1.665  0.00  0.00    +0.115 C 
ATOM     23  C   LIG    1       -4.790   0.158  -1.875  0.00  0.00    +0.130 C 
ATOM     24  C   LIG    1       -5.244   0.240  -3.326  0.00  0.00    +0.039 C 
ATOM     25  O   LIG    1       -5.969   0.021  -1.062  0.00  0.00    -0.371 OA
ATOM     26  C   LIG    1       -5.747  -0.725   0.147  0.00  0.00    +0.130 C 
ATOM     27  C   LIG    1       -6.764  -0.237   1.171  0.00  0.00    +0.039 C 
ATOM     28  C   LIG    1       -4.305  -0.560   0.671  0.00  0.00    +0.115 C 
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  29
ATOM     29  C   LIG    1       -0.556   2.193   2.435  0.00  0.00    +0.109 C 
BRANCH  29  30
ATOM     30  C   LIG    1       -1.467   2.873   1.436  0.00  0.00    -0.040 A 
ATOM     31  C   LIG    1       -2.838   3.004   1.705  0.00  0.00    +0.004 A 
ATOM     32  C   LIG    1       -3.684   3.631   0.788  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -3.168   4.148  -0.398  0.00  0.00    +0.000 A 
ATOM     34  C   LIG    1       -1.804   4.048  -0.665  0.00  0.00    +0.000 A 
ATOM     35  C   LIG    1       -0.957   3.421   0.249  0.00  0.00    +0.004 A 
ENDBRANCH  29  30
ENDBRANCH  10  29
TORSDOF 6