REMARK  Name = BDB058299
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.249  -0.115  -0.460  0.00  0.00    -0.285 N 
ATOM      2  H   LIG    1        1.882  -0.836  -1.069  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        1.317   0.648   0.228  0.00  0.00    +0.218 C 
ATOM      4  O   LIG    1        1.555   1.564   1.006  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   1   8
ATOM      5  C   LIG    1        6.473   0.099  -0.469  0.00  0.00    +0.120 A 
ATOM      6  C   LIG    1        5.791  -0.836  -1.244  0.00  0.00    +0.047 A 
ATOM      7  C   LIG    1        4.391  -0.882  -1.220  0.00  0.00    +0.027 A 
ATOM      8  C   LIG    1        3.653   0.003  -0.423  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1        4.341   0.937   0.350  0.00  0.00    +0.027 A 
ATOM     10  C   LIG    1        5.740   0.982   0.325  0.00  0.00    +0.047 A 
BRANCH   5  12
ATOM     11  C   LIG    1        8.619  -0.620  -1.194  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1        7.829   0.254  -0.398  0.00  0.00    -0.495 OA
ENDBRANCH   5  12
ENDBRANCH   1   8
BRANCH   3  13
ATOM     13  C   LIG    1       -0.101   0.190  -0.072  0.00  0.00    +0.111 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -1.137   1.133   0.543  0.00  0.00    +0.094 C 
BRANCH  14  15
ATOM     15  N   LIG    1       -2.520   0.770   0.175  0.00  0.00    -0.297 NA
ATOM     16  C   LIG    1       -2.953  -0.472   0.850  0.00  0.00    +0.119 C 
ATOM     17  C   LIG    1       -4.425  -0.788   0.676  0.00  0.00    -0.030 A 
ATOM     18  C   LIG    1       -5.341   0.211   0.302  0.00  0.00    -0.042 A 
ATOM     19  C   LIG    1       -6.701  -0.101   0.174  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -7.155  -1.392   0.442  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -6.255  -2.380   0.833  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -4.846   1.597  -0.020  0.00  0.00    +0.051 C 
ATOM     23  C   LIG    1       -4.897  -2.080   0.952  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1       -3.442   1.863   0.537  0.00  0.00    +0.089 C 
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH   3  13
TORSDOF 5