REMARK  Name = BDB024054
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.293  -0.198   1.026  0.00  0.00    +0.007 A 
ATOM      2  C   LIG    1       -3.559  -0.066   2.482  0.00  0.00    -0.010 A 
ATOM      3  C   LIG    1       -2.542  -0.167   3.372  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1       -1.206  -0.378   2.938  0.00  0.00    +0.138 A 
ATOM      5  N   LIG    1       -0.990  -0.507   1.572  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1        0.364  -0.729   1.403  0.00  0.00    +0.091 A 
ATOM      7  C   LIG    1        0.892  -0.635   2.677  0.00  0.00    +0.141 A 
ATOM      8  N   LIG    1       -0.085  -0.452   3.620  0.00  0.00    -0.235 NA
ATOM      9  C   LIG    1       -2.016  -0.405   0.635  0.00  0.00    +0.102 A 
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1       -6.137   1.255  -2.746  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1       -5.580   0.537  -1.626  0.00  0.00    -0.274 N 
ATOM     12  N   LIG    1       -6.193  -0.577  -1.181  0.00  0.00    -0.179 NA
ATOM     13  C   LIG    1       -5.425  -0.977  -0.164  0.00  0.00    +0.143 A 
ATOM     14  C   LIG    1       -4.332  -0.113   0.048  0.00  0.00    +0.021 A 
ATOM     15  C   LIG    1       -4.453   0.855  -0.923  0.00  0.00    +0.116 A 
ENDBRANCH   1  14
BRANCH   6  16
ATOM     16  C   LIG    1        1.039  -0.956   0.140  0.00  0.00    +0.091 A 
ATOM     17  N   LIG    1        2.032  -0.079  -0.122  0.00  0.00    -0.231 NA
ATOM     18  C   LIG    1        2.721  -0.232  -1.267  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1        2.433  -1.244  -2.176  0.00  0.00    +0.043 A 
ATOM     20  C   LIG    1        1.414  -2.148  -1.887  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1        0.704  -2.008  -0.702  0.00  0.00    +0.030 A 
BRANCH  18  22
ATOM     22  N   LIG    1        3.724   0.707  -1.510  0.00  0.00    -0.325 N 
ATOM     23  H   LIG    1        3.683   1.337  -0.701  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  C   LIG    1        5.084   0.147  -1.589  0.00  0.00    +0.087 C 
ATOM     25  C   LIG    1        5.666  -0.134  -0.196  0.00  0.00    +0.103 C 
ATOM     26  N   LIG    1        6.049   1.200   0.282  0.00  0.00    -0.314 NA
ATOM     27  H   LIG    1        6.709   1.138   1.056  0.00  0.00    +0.122 HD
ATOM     28  C   LIG    1        6.642   1.875  -0.871  0.00  0.00    +0.083 C 
ATOM     29  C   LIG    1        6.026   1.233  -2.113  0.00  0.00    +0.038 C 
ENDBRANCH  22  24
ENDBRANCH  18  22
ENDBRANCH   6  16
BRANCH   2  30
ATOM     30  C   LIG    1       -4.981   0.216   2.920  0.00  0.00    +0.191 C 
BRANCH  30  31
ATOM     31  O   LIG    1       -5.058   0.592   4.291  0.00  0.00    -0.390 OA
ATOM     32  H   LIG    1       -4.645   1.470   4.364  0.00  0.00    +0.210 HD
ENDBRANCH  30  31
ENDBRANCH   2  30
TORSDOF 6