REMARK  Name = BDB020610
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.340  -0.343   0.619  0.00  0.00    +0.043 A 
ATOM      2  C   LIG    1       -1.031   0.050   0.971  0.00  0.00    -0.017 A 
ATOM      3  C   LIG    1       -1.137   1.180   1.968  0.00  0.00    +0.046 C 
ATOM      4  C   LIG    1       -2.080  -0.606   0.388  0.00  0.00    +0.044 A 
ATOM      5  N   LIG    1       -1.774  -1.611  -0.577  0.00  0.00    -0.317 N 
ATOM      6  C   LIG    1       -0.465  -1.988  -0.906  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1       -0.493  -2.997  -1.845  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -1.841  -3.224  -2.138  0.00  0.00    +0.036 A 
ATOM      9 BR   LIG    1       -2.458  -4.474  -3.387  0.00  0.00    -0.049 Br
ATOM     10  C   LIG    1       -2.604  -2.371  -1.383  0.00  0.00    +0.107 A 
ATOM     11  C   LIG    1        0.608  -1.322  -0.262  0.00  0.00    +0.039 A 
ENDROOT
BRANCH   1  14
ATOM     12  N   LIG    1        2.061   1.293   0.413  0.00  0.00    -0.307 N 
ATOM     13  H   LIG    1        1.577   1.535  -0.441  0.00  0.00    +0.149 HD
ATOM     14  C   LIG    1        1.538   0.310   1.217  0.00  0.00    +0.245 C 
ATOM     15  O   LIG    1        1.968  -0.015   2.314  0.00  0.00    -0.270 OA
BRANCH  12  16
ATOM     16  C   LIG    1        3.193   2.100   0.824  0.00  0.00    +0.145 C 
BRANCH  16  23
ATOM     17  C   LIG    1        8.312  -0.669   0.648  0.00  0.00    +0.063 C 
ATOM     18  C   LIG    1        6.992   0.034   0.578  0.00  0.00    +0.016 A 
ATOM     19  N   LIG    1        6.632   0.797   1.658  0.00  0.00    -0.326 N 
ATOM     20  H   LIG    1        7.254   0.886   2.452  0.00  0.00    +0.169 HD
ATOM     21  C   LIG    1        5.463   1.509   1.756  0.00  0.00    +0.254 A 
ATOM     22  O   LIG    1        5.250   2.236   2.721  0.00  0.00    -0.268 OA
ATOM     23  C   LIG    1        4.497   1.380   0.610  0.00  0.00    +0.037 A 
ATOM     24  C   LIG    1        4.886   0.666  -0.473  0.00  0.00    -0.039 A 
ATOM     25  C   LIG    1        4.102   0.530  -1.748  0.00  0.00    +0.044 C 
ATOM     26  C   LIG    1        6.163  -0.036  -0.472  0.00  0.00    +0.024 A 
ENDBRANCH  16  23
ENDBRANCH  12  16
ENDBRANCH   1  14
BRANCH   4  27
ATOM     27  C   LIG    1       -3.536  -0.312   0.798  0.00  0.00    +0.101 C 
ATOM     28  C   LIG    1       -4.444  -1.532   1.031  0.00  0.00    +0.031 C 
BRANCH  27  29
ATOM     29  N   LIG    1       -4.112   0.845   0.090  0.00  0.00    -0.290 NA
ATOM     30  C   LIG    1       -4.269   0.773  -1.368  0.00  0.00    +0.113 C 
ATOM     31  C   LIG    1       -5.619   0.224  -1.854  0.00  0.00    +0.175 C 
ATOM     32  O   LIG    1       -6.713   0.932  -1.262  0.00  0.00    -0.377 OA
ATOM     33  C   LIG    1       -6.650   0.853   0.166  0.00  0.00    +0.175 C 
ATOM     34  C   LIG    1       -5.324   1.417   0.704  0.00  0.00    +0.113 C 
ENDBRANCH  27  29
ENDBRANCH   4  27
TORSDOF 5