REMARK  Name = BDB051630
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.592   0.109  -0.855  0.00  0.00    +0.065 A 
ATOM      2  C   LIG    1       -1.807   0.297  -2.000  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1       -0.416   0.411  -1.886  0.00  0.00    +0.015 A 
ATOM      4  C   LIG    1        0.204   0.350  -0.632  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -0.576   0.147   0.511  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1       -1.966   0.032   0.401  0.00  0.00    +0.028 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -7.241  -0.441   0.505  0.00  0.00    +0.064 A 
ATOM      8  C   LIG    1       -6.039  -0.263  -0.216  0.00  0.00    +0.105 A 
ATOM      9  C   LIG    1       -6.078  -0.124  -1.647  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1       -4.791   0.033  -2.075  0.00  0.00    +0.123 A 
ATOM     11  N   LIG    1       -4.011  -0.011  -0.941  0.00  0.00    -0.239 N 
ATOM     12  C   LIG    1       -7.196  -0.142  -2.473  0.00  0.00    +0.011 A 
ATOM     13  C   LIG    1       -8.378  -0.321  -1.728  0.00  0.00    +0.001 A 
ATOM     14  N   LIG    1       -4.755  -0.188   0.190  0.00  0.00    -0.166 NA
ATOM     15  C   LIG    1       -8.405  -0.464  -0.306  0.00  0.00    +0.015 A 
BRANCH   7  19
ATOM     16  N   LIG    1       -6.156  -0.561   2.669  0.00  0.00    -0.325 N 
ATOM     17  H   LIG    1       -5.263  -0.442   2.197  0.00  0.00    +0.145 HD
ATOM     18  H   LIG    1       -6.184  -0.669   3.672  0.00  0.00    +0.145 HD
ATOM     19  C   LIG    1       -7.325  -0.593   1.967  0.00  0.00    +0.244 C 
ATOM     20  O   LIG    1       -8.402  -0.743   2.529  0.00  0.00    -0.270 OA
ENDBRANCH   7  19
ENDBRANCH   1  11
BRANCH   4  21
ATOM     21  C   LIG    1        1.687   0.473  -0.572  0.00  0.00    +0.244 C 
ATOM     22  N   LIG    1        2.219   0.962   0.604  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1        1.608   1.373   1.295  0.00  0.00    +0.149 HD
ATOM     24  O   LIG    1        2.369   0.172  -1.545  0.00  0.00    -0.270 OA
BRANCH  22  25
ATOM     25  C   LIG    1        3.645   1.203   0.740  0.00  0.00    +0.120 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.455  -0.100   0.899  0.00  0.00    +0.103 C 
BRANCH  26  27
ATOM     27  N   LIG    1        5.879   0.127   1.207  0.00  0.00    -0.297 NA
ATOM     28  C   LIG    1        6.573  -1.145   1.515  0.00  0.00    +0.112 C 
ATOM     29  C   LIG    1        7.377  -1.710   0.334  0.00  0.00    +0.175 C 
ATOM     30  O   LIG    1        8.401  -0.816  -0.124  0.00  0.00    -0.377 OA
ATOM     31  C   LIG    1        8.082   0.564   0.099  0.00  0.00    +0.175 C 
ATOM     32  C   LIG    1        6.569   0.832   0.100  0.00  0.00    +0.112 C 
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH   4  21
TORSDOF 6