REMARK  Name = BDB062308
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.363  -0.209  -0.174  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1       -0.100   0.397  -0.054  0.00  0.00    +0.035 A 
ATOM      3  C   LIG    1        1.089  -0.352  -0.090  0.00  0.00    +0.021 A 
ATOM      4  C   LIG    1        0.988  -1.735  -0.286  0.00  0.00    +0.051 A 
ATOM      5  N   LIG    1        2.146  -2.509  -0.395  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1        2.088  -3.505  -0.556  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1        3.409  -1.992  -0.348  0.00  0.00    +0.254 A 
ATOM      8  C   LIG    1        3.529  -0.527  -0.113  0.00  0.00    +0.038 A 
ATOM      9  C   LIG    1        4.924   0.034  -0.033  0.00  0.00    +0.044 C 
ATOM     10  C   LIG    1        4.948   1.563  -0.132  0.00  0.00    +0.023 C 
ATOM     11  C   LIG    1        3.846   2.176   0.722  0.00  0.00    +0.102 C 
ATOM     12  N   LIG    1        2.558   1.607   0.338  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1        1.790   1.965   0.899  0.00  0.00    +0.146 HD
ATOM     14  O   LIG    1        4.395  -2.712  -0.476  0.00  0.00    -0.268 OA
ATOM     15  C   LIG    1       -0.254  -2.360  -0.396  0.00  0.00    +0.028 A 
ATOM     16  C   LIG    1        2.438   0.251   0.043  0.00  0.00    +0.045 A 
ATOM     17  C   LIG    1       -1.421  -1.597  -0.329  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  18
ATOM     18  N   LIG    1       -2.512   0.602  -0.081  0.00  0.00    -0.313 N 
ATOM     19  H   LIG    1       -2.358   1.539  -0.449  0.00  0.00    +0.152 HD
BRANCH  18  26
ATOM     20  C   LIG    1       -4.936   0.987  -0.261  0.00  0.00    +0.110 A 
ATOM     21  C   LIG    1       -6.214   0.610   0.133  0.00  0.00    +0.148 A 
ATOM     22 CL   LIG    1       -7.645   1.358  -0.469  0.00  0.00    -0.061 Cl
ATOM     23  N   LIG    1       -6.481  -0.373   1.022  0.00  0.00    -0.242 NA
ATOM     24  C   LIG    1       -5.423  -1.014   1.548  0.00  0.00    +0.114 A 
ATOM     25  C   LIG    1       -4.110  -0.719   1.220  0.00  0.00    +0.044 A 
ATOM     26  C   LIG    1       -3.840   0.303   0.300  0.00  0.00    +0.053 A 
BRANCH  20  28
ATOM     27  N   LIG    1       -4.529   2.897  -1.957  0.00  0.00    -0.191 NA
ATOM     28  C   LIG    1       -4.743   2.038  -1.207  0.00  0.00    +0.104 C 
ENDBRANCH  20  28
ENDBRANCH  18  26
ENDBRANCH   1  18
TORSDOF 3