REMARK  Name = BDB009123
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.822   1.379   0.345  0.00  0.00    +0.065 A 
ATOM      2  C   LIG    1       -2.046   0.521   0.298  0.00  0.00    -0.016 A 
ATOM      3  C   LIG    1       -1.987  -0.936   0.663  0.00  0.00    +0.037 C 
ATOM      4  C   LIG    1       -3.367  -1.587   0.812  0.00  0.00    +0.005 C 
ATOM      5  C   LIG    1       -4.320  -1.129  -0.284  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1       -4.489   0.392  -0.258  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1       -3.185   1.121  -0.093  0.00  0.00    +0.023 A 
ATOM      8  C   LIG    1       -3.196   2.575  -0.394  0.00  0.00    +0.268 A 
ATOM      9  O   LIG    1       -4.222   3.157  -0.732  0.00  0.00    -0.266 OA
ATOM     10  N   LIG    1       -1.998   3.222  -0.262  0.00  0.00    -0.243 N 
ATOM     11  H   LIG    1       -1.982   4.215  -0.467  0.00  0.00    +0.192 HD
ATOM     12  N   LIG    1       -0.814   2.650   0.080  0.00  0.00    -0.176 NA
ENDROOT
BRANCH   1  13
ATOM     13  C   LIG    1        0.524   0.753   0.673  0.00  0.00    +0.062 C 
BRANCH  13  14
ATOM     14  C   LIG    1        1.214   0.304  -0.613  0.00  0.00    +0.041 C 
BRANCH  14  17
ATOM     15  C   LIG    1        4.913  -0.248   0.155  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1        3.697   0.368  -0.159  0.00  0.00    +0.026 A 
ATOM     17  C   LIG    1        2.524  -0.384  -0.326  0.00  0.00    -0.045 A 
ATOM     18  C   LIG    1        2.585  -1.777  -0.205  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        3.804  -2.404   0.047  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        4.963  -1.642   0.205  0.00  0.00    +0.023 A 
BRANCH  15  21
ATOM     21  N   LIG    1        6.093   0.503   0.199  0.00  0.00    -0.358 N 
ATOM     22  H   LIG    1        6.840   0.062   0.726  0.00  0.00    +0.142 HD
ATOM     23  H   LIG    1        5.952   1.472   0.466  0.00  0.00    +0.142 HD
ENDBRANCH  15  21
ENDBRANCH  14  17
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 4