REMARK  Name = BDB028473
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.736  -1.904   2.877  0.00  0.00    -0.253 OA
ATOM      2  C   LIG    1       -0.590  -1.438   1.752  0.00  0.00    +0.302 C 
ATOM      3  N   LIG    1       -1.631  -0.898   1.013  0.00  0.00    -0.286 N 
ATOM      4  C   LIG    1       -2.937  -0.782   1.657  0.00  0.00    +0.109 C 
ATOM      5  C   LIG    1       -3.773   0.331   1.034  0.00  0.00    +0.023 C 
ATOM      6  C   LIG    1       -4.004   0.122  -0.477  0.00  0.00    -0.004 C 
ATOM      7  C   LIG    1       -2.906  -0.761  -1.102  0.00  0.00    +0.023 C 
ATOM      8  C   LIG    1       -1.559  -0.577  -0.413  0.00  0.00    +0.109 C 
ATOM      9  N   LIG    1        0.627  -1.412   1.115  0.00  0.00    -0.297 N 
ATOM     10  H   LIG    1        0.756  -0.559   0.589  0.00  0.00    +0.150 HD
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1       -5.389  -0.483  -0.793  0.00  0.00    +0.038 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -6.547   0.446  -0.512  0.00  0.00    -0.047 A 
ATOM     13  C   LIG    1       -7.446   0.169   0.527  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1       -8.516   1.027   0.785  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -8.701   2.167   0.005  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -7.818   2.449  -1.034  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -6.747   1.592  -1.294  0.00  0.00    +0.003 A 
ENDBRANCH  11  12
ENDBRANCH   6  11
BRANCH   9  18
ATOM     18  C   LIG    1        1.823  -1.853   1.823  0.00  0.00    +0.138 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.954  -2.241   0.856  0.00  0.00    +0.146 C 
BRANCH  19  20
ATOM     20  O   LIG    1        2.511  -3.336   0.036  0.00  0.00    -0.389 OA
ATOM     21  H   LIG    1        1.549  -3.214  -0.081  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        3.421  -1.097  -0.073  0.00  0.00    +0.117 C 
BRANCH  22  23
ATOM     23  N   LIG    1        3.766   0.168   0.600  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        4.040   1.241  -0.378  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        5.397   1.171  -1.047  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        6.465   0.479  -0.446  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        7.720   0.461  -1.069  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        7.922   1.143  -2.267  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.872   1.845  -2.855  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.246  -0.294   0.830  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        5.617   1.863  -2.247  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        4.917   0.058   1.516  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   9  18
TORSDOF 7