REMARK  Name = BDB027651
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.017   0.503  -0.877  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -0.239  -0.041  -2.152  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -1.459  -0.698  -2.310  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1       -1.691  -1.253  -3.560  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -0.850  -1.206  -4.627  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.309  -0.551  -4.443  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -2.369  -0.800  -1.329  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1       -2.075  -0.220  -0.154  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.658   0.040  -3.243  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -0.931   0.430   0.105  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -3.072  -0.311   0.928  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1       -2.854   0.288   2.179  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1       -3.818   0.176   3.168  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1       -4.981  -0.486   3.009  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1       -5.188  -1.058   1.806  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1       -4.283  -0.999   0.758  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        1.195   1.190  -0.608  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1        1.977   0.600  -0.903  0.00  0.00    +0.148 HD
BRANCH  17  21
ATOM     19  C   LIG    1        3.391   1.003   1.256  0.00  0.00    +0.121 C 
ATOM     20  C   LIG    1        1.939   0.748   1.732  0.00  0.00    +0.054 C 
ATOM     21  C   LIG    1        1.471   1.781   0.680  0.00  0.00    +0.077 C 
ATOM     22  C   LIG    1        2.897   2.375   0.730  0.00  0.00    +0.054 C 
BRANCH  19  24
ATOM     23  C   LIG    1        4.393  -1.139   0.697  0.00  0.00    +0.194 C 
ATOM     24  O   LIG    1        3.886   0.105   0.231  0.00  0.00    -0.380 OA
ENDBRANCH  19  24
ENDBRANCH  17  21
ENDBRANCH   1  17
TORSDOF 4