REMARK  Name = BDB059738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.015  -0.052   1.082  0.00  0.00    +0.142 A 
ATOM      2  N   LIG    1        2.886   0.352   0.088  0.00  0.00    -0.321 N 
ATOM      3  C   LIG    1        2.523   0.734  -1.263  0.00  0.00    +0.142 C 
ATOM      4  C   LIG    1        3.557   0.314  -2.299  0.00  0.00    +0.126 C 
ATOM      5  N   LIG    1        4.757   1.126  -2.263  0.00  0.00    -0.310 N 
ATOM      6  H   LIG    1        5.120   1.478  -3.143  0.00  0.00    +0.149 HD
ATOM      7  C   LIG    1        5.701   1.166  -1.270  0.00  0.00    +0.248 C 
ATOM      8  C   LIG    1        5.430   0.594   0.058  0.00  0.00    +0.080 A 
ATOM      9  C   LIG    1        6.492   0.361   0.932  0.00  0.00    +0.126 A 
ATOM     10  N   LIG    1        6.383  -0.154   2.183  0.00  0.00    -0.260 NA
ATOM     11  C   LIG    1        5.146  -0.458   2.653  0.00  0.00    +0.140 A 
ATOM     12  C   LIG    1        4.016  -0.241   1.858  0.00  0.00    +0.108 A 
ATOM     13  O   LIG    1        6.789   1.685  -1.505  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        4.171   0.279   0.574  0.00  0.00    +0.084 A 
ATOM     15  N   LIG    1        2.692  -0.463   2.137  0.00  0.00    -0.226 NA
ENDROOT
BRANCH   1  19
ATOM     16  C   LIG    1       -2.257  -0.132   0.792  0.00  0.00    -0.034 A 
ATOM     17  C   LIG    1       -1.557   1.060   0.561  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1       -0.163   1.095   0.660  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1        0.556  -0.066   0.977  0.00  0.00    +0.017 A 
ATOM     20  C   LIG    1       -0.143  -1.253   1.219  0.00  0.00    +0.012 A 
ATOM     21  C   LIG    1       -1.536  -1.289   1.116  0.00  0.00    +0.005 A 
BRANCH  16  22
ATOM     22  C   LIG    1       -3.765  -0.181   0.678  0.00  0.00    +0.116 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -4.157  -0.784  -0.594  0.00  0.00    -0.310 NA
ATOM     24  H   LIG    1       -3.700  -0.274  -1.349  0.00  0.00    +0.122 HD
BRANCH  23  26
ATOM     25  C   LIG    1       -6.369  -1.624   0.215  0.00  0.00    +0.023 C 
ATOM     26  C   LIG    1       -5.601  -0.838  -0.848  0.00  0.00    +0.048 C 
ATOM     27  C   LIG    1       -6.216   0.547  -1.062  0.00  0.00    +0.023 C 
ENDBRANCH  23  26
ENDBRANCH  22  23
ENDBRANCH  16  22
ENDBRANCH   1  19
TORSDOF 4