REMARK  Name = BDB016388
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.120   1.532  -0.767  0.00  0.00    +0.005 A 
ATOM      2  C   LIG    1        2.270   0.807  -0.305  0.00  0.00    +0.057 A 
ATOM      3  N   LIG    1        2.046  -0.479   0.231  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1        1.186  -0.876  -0.147  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1        3.133  -1.445   0.262  0.00  0.00    +0.076 C 
ATOM      6  C   LIG    1        4.075  -1.071   1.383  0.00  0.00    +0.118 C 
ATOM      7  C   LIG    1        5.101  -0.105   0.890  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1        4.757   0.980   0.155  0.00  0.00    -0.284 N 
ATOM      9  H   LIG    1        5.571   1.557  -0.019  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        6.292  -0.253   1.187  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1        2.532  -2.830   0.523  0.00  0.00    +0.028 C 
ATOM     12  C   LIG    1        3.525   1.464  -0.335  0.00  0.00    +0.055 A 
ATOM     13  C   LIG    1        3.623   2.748  -0.911  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1        2.510   3.418  -1.403  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        1.265   2.818  -1.318  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  19
ATOM     16  C   LIG    1       -2.857  -0.101  -0.560  0.00  0.00    +0.121 A 
ATOM     17  C   LIG    1       -2.203   0.307   0.600  0.00  0.00    +0.046 A 
ATOM     18  C   LIG    1       -0.909   0.839   0.529  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1       -0.246   0.974  -0.700  0.00  0.00    -0.016 A 
ATOM     20  C   LIG    1       -0.916   0.569  -1.861  0.00  0.00    +0.012 A 
ATOM     21  C   LIG    1       -2.208   0.038  -1.789  0.00  0.00    +0.046 A 
BRANCH  16  22
ATOM     22  O   LIG    1       -4.113  -0.631  -0.643  0.00  0.00    -0.489 OA
BRANCH  22  24
ATOM     23  C   LIG    1       -5.618   0.274   1.025  0.00  0.00    +0.051 C 
ATOM     24  C   LIG    1       -4.823  -0.942   0.560  0.00  0.00    +0.167 C 
ATOM     25  C   LIG    1       -5.775  -2.088   0.222  0.00  0.00    +0.051 C 
ENDBRANCH  22  24
ENDBRANCH  16  22
ENDBRANCH   1  19
TORSDOF 3