REMARK  Name = BDB055359
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        6.963   0.466   0.971  0.00  0.00    +0.045 C 
ATOM      2  C   LIG    1        5.580   0.308   0.453  0.00  0.00    -0.032 A 
ATOM      3  C   LIG    1        4.406   0.357   1.184  0.00  0.00    +0.094 A 
ATOM      4  N   LIG    1        3.345   0.168   0.332  0.00  0.00    -0.316 N 
ATOM      5  C   LIG    1        3.829  -0.002  -0.946  0.00  0.00    +0.111 A 
ATOM      6  C   LIG    1        2.915  -0.222  -2.042  0.00  0.00    +0.273 A 
ATOM      7  N   LIG    1        1.578  -0.243  -1.677  0.00  0.00    -0.319 N 
ATOM      8  H   LIG    1        0.923  -0.379  -2.438  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1        1.111  -0.065  -0.390  0.00  0.00    +0.066 A 
ATOM     10  O   LIG    1        3.251  -0.381  -3.212  0.00  0.00    -0.266 OA
ATOM     11  C   LIG    1        1.986   0.137   0.611  0.00  0.00    +0.117 A 
ATOM     12  C   LIG    1        5.205   0.081  -0.901  0.00  0.00    +0.036 A 
ENDROOT
BRANCH   9  13
ATOM     13  C   LIG    1       -0.340  -0.118  -0.159  0.00  0.00    -0.000 A 
ATOM     14  C   LIG    1       -1.013   0.950   0.444  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -2.397   0.900   0.651  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1       -3.146  -0.221   0.265  0.00  0.00    -0.017 A 
ATOM     17  C   LIG    1       -2.460  -1.285  -0.350  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1       -1.078  -1.236  -0.559  0.00  0.00    +0.010 A 
BRANCH  16  19
ATOM     19  C   LIG    1       -4.659  -0.317   0.462  0.00  0.00    +0.085 C 
ATOM     20  C   LIG    1       -5.383  -0.153  -0.879  0.00  0.00    +0.046 C 
ATOM     21  C   LIG    1       -5.241   0.673   1.479  0.00  0.00    +0.046 C 
BRANCH  19  22
ATOM     22  O   LIG    1       -4.973  -1.624   0.964  0.00  0.00    -0.385 OA
ATOM     23  H   LIG    1       -4.310  -1.833   1.644  0.00  0.00    +0.211 HD
ENDBRANCH  19  22
ENDBRANCH  16  19
ENDBRANCH   9  13
TORSDOF 3