REMARK  Name = BDB026398
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.338   2.537   0.633  0.00  0.00    +0.154 C 
ATOM      2  N   LIG    1        1.556   1.390   0.284  0.00  0.00    -0.293 N 
ATOM      3  C   LIG    1        2.028   0.091   0.006  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1        0.900  -0.717  -0.223  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        1.006  -2.071  -0.473  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        2.286  -2.624  -0.477  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        3.418  -1.819  -0.248  0.00  0.00    +0.025 A 
ATOM      8  N   LIG    1       -0.246   0.088  -0.120  0.00  0.00    -0.280 N 
ATOM      9  C   LIG    1        3.315  -0.434  -0.048  0.00  0.00    +0.051 A 
ATOM     10  C   LIG    1        0.148   1.394   0.229  0.00  0.00    +0.331 A 
ATOM     11  O   LIG    1       -0.592   2.341   0.446  0.00  0.00    -0.246 OA
ENDROOT
BRANCH   8  12
ATOM     12  C   LIG    1       -1.620  -0.359  -0.210  0.00  0.00    +0.179 C 
ATOM     13  C   LIG    1       -2.257  -0.404   1.186  0.00  0.00    +0.242 C 
ATOM     14  O   LIG    1       -1.637  -0.663   2.216  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -3.626  -0.250   1.228  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -4.046  -0.311   2.145  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -4.495  -0.116   0.175  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -5.710  -0.113   0.352  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.884  -0.065  -1.206  0.00  0.00    +0.099 C 
ATOM     20  C   LIG    1       -2.468   0.487  -1.162  0.00  0.00    +0.044 C 
ENDBRANCH   8  12
BRANCH   9  21
ATOM     21  N   LIG    1        4.481   0.267   0.297  0.00  0.00    -0.356 N 
ATOM     22  H   LIG    1        4.420   1.256   0.087  0.00  0.00    +0.142 HD
ATOM     23  H   LIG    1        4.692   0.141   1.286  0.00  0.00    +0.142 HD
ENDBRANCH   9  21
TORSDOF 2