REMARK  Name = BDB005624
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.311  -0.663   0.226  0.00  0.00    -0.028 A 
ATOM      2  C   LIG    1        0.651   0.086   1.208  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1       -0.707   0.396   1.074  0.00  0.00    +0.055 A 
ATOM      4  C   LIG    1       -1.458  -0.037  -0.032  0.00  0.00    +0.061 A 
ATOM      5  C   LIG    1       -2.889   0.366  -0.099  0.00  0.00    +0.048 A 
ATOM      6  N   LIG    1       -3.653  -0.003  -1.200  0.00  0.00    -0.343 N 
ATOM      7  H   LIG    1       -3.080  -0.228  -2.016  0.00  0.00    +0.146 HD
ATOM      8  C   LIG    1       -4.917   0.650  -1.494  0.00  0.00    +0.102 C 
ATOM      9  C   LIG    1       -5.702   0.806  -0.197  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -4.872   1.540   0.863  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -3.431   1.101   0.893  0.00  0.00    +0.038 A 
ATOM     12  C   LIG    1       -2.623   1.537   2.061  0.00  0.00    +0.254 A 
ATOM     13  O   LIG    1       -3.102   2.212   2.967  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1       -0.790  -0.823  -0.991  0.00  0.00    +0.131 A 
ATOM     15  N   LIG    1       -1.311   1.161   2.076  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1       -0.774   1.477   2.873  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1        0.578  -1.113  -0.876  0.00  0.00    +0.051 A 
ENDROOT
BRANCH  14  18
ATOM     18  O   LIG    1       -1.435  -1.287  -2.115  0.00  0.00    -0.494 OA
ATOM     19  C   LIG    1       -1.802  -2.658  -1.930  0.00  0.00    +0.277 C 
ENDBRANCH  14  18
BRANCH   1  20
ATOM     20  C   LIG    1        2.783  -0.989   0.365  0.00  0.00    +0.119 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.639   0.203   0.497  0.00  0.00    -0.299 NA
BRANCH  21  23
ATOM     22  C   LIG    1        5.137  -0.581   2.328  0.00  0.00    +0.020 C 
ATOM     23  C   LIG    1        5.018  -0.148   0.869  0.00  0.00    +0.081 C 
ENDBRANCH  21  23
BRANCH  21  24
ATOM     24  C   LIG    1        3.609   1.075  -0.693  0.00  0.00    +0.081 C 
ATOM     25  C   LIG    1        4.140   0.476  -1.994  0.00  0.00    +0.020 C 
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 5