REMARK  Name = BDB007488
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.990   1.623   0.552  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -1.988   0.500   1.044  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1       -0.832  -0.157   1.415  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1       -0.860  -1.167   1.483  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -3.264  -0.247   1.226  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1       -4.362   0.108   0.427  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1       -5.595  -0.556   0.548  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1       -5.700  -1.583   1.501  0.00  0.00    +0.008 A 
ATOM      9  C   LIG    1       -4.616  -1.931   2.311  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -3.400  -1.263   2.178  0.00  0.00    +0.013 A 
BRANCH   7  11
ATOM     11  C   LIG    1       -6.742  -0.186  -0.299  0.00  0.00    -0.015 A 
ATOM     12  C   LIG    1       -6.621  -0.116  -1.692  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1       -7.730   0.233  -2.448  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1       -8.939   0.515  -1.922  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1       -9.041   0.449  -0.580  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1       -7.992   0.107   0.259  0.00  0.00    +0.028 A 
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  17
ATOM     17  C   LIG    1        0.471   0.411   1.102  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  C   LIG    1        0.887   0.088  -0.338  0.00  0.00    +0.145 C 
BRANCH  18  19
ATOM     19  O   LIG    1        1.211  -1.313  -0.426  0.00  0.00    -0.389 OA
ATOM     20  H   LIG    1        2.191  -1.345  -0.383  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1        2.085   0.917  -0.857  0.00  0.00    +0.117 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.398   0.406  -0.406  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        4.461   0.793  -1.348  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        5.789   0.213  -0.926  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1        6.156   0.329   0.423  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        7.395  -0.149   0.857  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        8.259  -0.759  -0.051  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        7.896  -0.881  -1.393  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.202   1.041   1.340  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1        6.665  -0.391  -1.833  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        3.719   0.779   0.988  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 7