REMARK  Name = BDB057834
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.862  -0.513   0.964  0.00  0.00    +0.163 A 
ATOM      2  N   LIG    1       -3.382  -1.747   1.128  0.00  0.00    -0.224 NA
ATOM      3  C   LIG    1       -2.450  -2.720   1.137  0.00  0.00    +0.115 A 
ATOM      4  C   LIG    1       -1.097  -2.471   1.001  0.00  0.00    +0.192 A 
ATOM      5  O   LIG    1       -0.391  -3.638   1.038  0.00  0.00    -0.458 OA
ATOM      6  C   LIG    1       -1.305  -4.634   1.207  0.00  0.00    +0.198 A 
ATOM      7  C   LIG    1       -0.616  -1.177   0.846  0.00  0.00    +0.166 A 
ATOM      8  C   LIG    1       -2.583  -4.120   1.273  0.00  0.00    +0.069 A 
ATOM      9  N   LIG    1       -1.548  -0.195   0.833  0.00  0.00    -0.209 NA
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1       -4.955   0.703   0.147  0.00  0.00    -0.034 A 
ATOM     11  C   LIG    1       -3.806   0.620   0.978  0.00  0.00    +0.023 A 
ATOM     12  C   LIG    1       -3.555   1.680   1.879  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -4.415   2.771   1.992  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -5.555   2.830   1.204  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -5.823   1.808   0.293  0.00  0.00    +0.004 A 
BRANCH  10  17
ATOM     16  C   LIG    1       -5.568   0.237  -2.284  0.00  0.00    +0.012 C 
ATOM     17  C   LIG    1       -5.281  -0.361  -0.900  0.00  0.00    +0.014 C 
ATOM     18  C   LIG    1       -6.449  -1.237  -0.440  0.00  0.00    +0.012 C 
ENDBRANCH  10  17
ENDBRANCH   1  11
BRANCH   7  19
ATOM     19  N   LIG    1        0.742  -0.893   0.725  0.00  0.00    -0.322 N 
ATOM     20  H   LIG    1        1.275  -1.709   0.437  0.00  0.00    +0.148 HD
BRANCH  19  21
ATOM     21  C   LIG    1        1.057   0.331   0.013  0.00  0.00    +0.138 C 
BRANCH  21  22
ATOM     22  C   LIG    1        2.555   0.430  -0.156  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1        3.154   0.218  -1.403  0.00  0.00    +0.006 A 
ATOM     24  C   LIG    1        4.543   0.300  -1.546  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        5.372   0.590  -0.450  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1        4.762   0.794   0.798  0.00  0.00    +0.009 A 
ATOM     27  C   LIG    1        3.374   0.714   0.944  0.00  0.00    +0.006 A 
BRANCH  25  28
ATOM     28  C   LIG    1        6.832   0.672  -0.604  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.703  -0.046   0.217  0.00  0.00    +0.119 A 
ATOM     30  N   LIG    1        9.056  -0.013   0.131  0.00  0.00    -0.263 NA
ATOM     31  C   LIG    1        9.580   0.777  -0.828  0.00  0.00    +0.111 A 
ATOM     32  C   LIG    1        8.816   1.533  -1.701  0.00  0.00    +0.020 A 
ATOM     33  C   LIG    1        7.428   1.476  -1.584  0.00  0.00    +0.011 A 
ENDBRANCH  25  28
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   7  19
TORSDOF 6