REMARK  Name = BDB007481
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.477  -2.151  -0.535  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1       -1.335  -1.872   0.806  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1       -1.756  -1.033   1.187  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -0.745  -2.929  -1.138  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1       -4.666  -0.221  -1.319  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -3.683  -0.917  -0.603  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1       -2.548  -1.412  -1.259  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1       -2.415  -1.235  -2.642  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1       -3.396  -0.553  -3.360  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -4.517  -0.047  -2.700  0.00  0.00    +0.010 A 
BRANCH   5  13
ATOM     11  C   LIG    1       -5.535   2.755  -1.113  0.00  0.00    +0.173 C 
ATOM     12  N   LIG    1       -6.226   1.610  -0.565  0.00  0.00    -0.267 N 
ATOM     13  C   LIG    1       -5.846   0.287  -0.628  0.00  0.00    +0.069 A 
ATOM     14  C   LIG    1       -6.800  -0.391   0.109  0.00  0.00    +0.049 A 
ATOM     15  C   LIG    1       -7.711   0.589   0.534  0.00  0.00    +0.135 A 
ATOM     16  N   LIG    1       -7.369   1.810   0.121  0.00  0.00    -0.179 NA
ENDBRANCH   5  13
ENDBRANCH   1   7
BRANCH   2  17
ATOM     17  C   LIG    1       -0.248  -2.429   1.595  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  C   LIG    1        0.961  -1.488   1.702  0.00  0.00    +0.145 C 
BRANCH  18  19
ATOM     19  O   LIG    1        0.533  -0.222   2.232  0.00  0.00    -0.389 OA
ATOM     20  H   LIG    1        1.249   0.400   1.981  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1        1.687  -1.254   0.359  0.00  0.00    +0.117 C 
BRANCH  21  22
ATOM     22  N   LIG    1        2.773  -0.247   0.492  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        3.924  -0.795   1.244  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        5.143   0.105   1.239  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1        5.304   1.100   0.260  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        6.455   1.900   0.261  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        7.453   1.696   1.213  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        7.307   0.698   2.172  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        4.212   1.345  -0.747  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1        6.160  -0.096   2.185  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        3.232   0.168  -0.848  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   2  17
TORSDOF 7