REMARK  Name = BDB034163
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.051   1.174  -1.816  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1       -0.330  -0.245  -1.691  0.00  0.00    +0.089 C 
ATOM      3  C   LIG    1       -1.626  -0.481  -0.894  0.00  0.00    +0.051 C 
ATOM      4  C   LIG    1       -2.720   0.496  -1.268  0.00  0.00    -0.040 C 
ATOM      5  C   LIG    1       -2.421   1.589  -1.997  0.00  0.00    -0.007 C 
ATOM      6  C   LIG    1       -1.032   1.916  -2.479  0.00  0.00    +0.112 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -4.097   0.214  -0.814  0.00  0.00    -0.004 A 
ATOM      8  C   LIG    1       -4.361  -0.330   0.446  0.00  0.00    +0.119 A 
ATOM      9  N   LIG    1       -5.596  -0.630   0.921  0.00  0.00    -0.250 NA
ATOM     10  C   LIG    1       -6.641  -0.374   0.084  0.00  0.00    +0.126 A 
ATOM     11  C   LIG    1       -6.495   0.155  -1.190  0.00  0.00    +0.033 A 
ATOM     12  C   LIG    1       -5.206   0.447  -1.638  0.00  0.00    +0.012 A 
BRANCH  10  13
ATOM     13  C   LIG    1       -8.006  -0.709   0.606  0.00  0.00    +0.275 C 
ATOM     14  N   LIG    1       -7.979  -1.174   1.946  0.00  0.00    -0.217 N 
ATOM     15  H   LIG    1       -7.053  -1.347   2.347  0.00  0.00    +0.167 HD
ATOM     16  O   LIG    1       -9.014  -0.579  -0.071  0.00  0.00    -0.268 OA
BRANCH  14  17
ATOM     17  C   LIG    1       -9.090  -1.789   2.333  0.00  0.00    +0.173 C 
ATOM     18  N   LIG    1      -10.024  -2.354   2.720  0.00  0.00    -0.174 NA
ENDBRANCH  14  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1        0.418   1.801  -0.535  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1        6.230  -0.505   1.299  0.00  0.00    +0.019 A 
ATOM     21  C   LIG    1        6.336  -0.045  -0.126  0.00  0.00    +0.252 A 
ATOM     22  O   LIG    1        7.385  -0.125  -0.756  0.00  0.00    -0.268 OA
ATOM     23  N   LIG    1        5.203   0.472  -0.700  0.00  0.00    -0.321 N 
ATOM     24  H   LIG    1        5.289   0.773  -1.661  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1        3.987   0.595  -0.020  0.00  0.00    +0.068 A 
ATOM     26  C   LIG    1        3.887   0.180   1.306  0.00  0.00    +0.088 A 
ATOM     27  N   LIG    1        2.754   0.265   2.036  0.00  0.00    -0.253 NA
ATOM     28  C   LIG    1        1.675   0.785   1.407  0.00  0.00    +0.116 A 
ATOM     29  C   LIG    1        1.667   1.220   0.081  0.00  0.00    -0.013 A 
ATOM     30  C   LIG    1        2.865   1.126  -0.641  0.00  0.00    +0.034 A 
ATOM     31  C   LIG    1        5.065  -0.378   1.960  0.00  0.00    +0.038 A 
BRANCH  20  33
ATOM     32  C   LIG    1        7.748  -2.497   1.510  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1        7.473  -1.062   1.937  0.00  0.00    +0.037 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 6