REMARK  Name = BDB008925
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.231  -0.666  -0.123  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.943  -0.963   0.582  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -1.912  -1.815   0.033  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -1.677  -2.383  -1.227  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.514  -2.081  -1.938  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.438  -1.219  -1.393  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        0.833   1.095   1.317  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.212   0.264   0.500  0.00  0.00    +0.244 C 
ATOM      9  N   LIG    1        2.532   0.097   0.131  0.00  0.00    -0.310 N 
ATOM     10  H   LIG    1        2.787  -0.791  -0.280  0.00  0.00    +0.149 HD
BRANCH   9  11
ATOM     11  C   LIG    1        3.581   0.851   0.801  0.00  0.00    +0.120 C 
BRANCH  11  12
ATOM     12  C   LIG    1        4.907   0.801   0.021  0.00  0.00    +0.103 C 
BRANCH  12  13
ATOM     13  N   LIG    1        5.981   1.591   0.648  0.00  0.00    -0.301 NA
ATOM     14  C   LIG    1        6.538   0.948   1.848  0.00  0.00    +0.084 C 
ATOM     15  C   LIG    1        7.600  -0.025   1.353  0.00  0.00    +0.017 C 
ATOM     16  C   LIG    1        7.975   0.468  -0.037  0.00  0.00    +0.017 C 
ATOM     17  C   LIG    1        7.143   1.723  -0.246  0.00  0.00    +0.084 C 
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  18
ATOM     18  C   LIG    1       -3.175  -2.131   0.800  0.00  0.00    +0.092 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -4.450  -1.822   0.019  0.00  0.00    +0.069 A 
ATOM     20  C   LIG    1       -4.894  -0.402  -0.149  0.00  0.00    -0.016 A 
ATOM     21  C   LIG    1       -4.131   0.730   0.480  0.00  0.00    +0.037 C 
ATOM     22  C   LIG    1       -4.910   2.050   0.498  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -5.597   2.298  -0.840  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -6.566   1.163  -1.177  0.00  0.00    +0.041 C 
ATOM     25  C   LIG    1       -6.003  -0.200  -0.882  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1       -6.740  -1.355  -1.452  0.00  0.00    +0.268 A 
ATOM     27  O   LIG    1       -7.763  -1.209  -2.113  0.00  0.00    -0.266 OA
ATOM     28  N   LIG    1       -6.212  -2.590  -1.192  0.00  0.00    -0.243 N 
ATOM     29  H   LIG    1       -6.702  -3.393  -1.572  0.00  0.00    +0.192 HD
ATOM     30  N   LIG    1       -5.084  -2.844  -0.478  0.00  0.00    -0.175 NA
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 6