REMARK  Name = BDB031285
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.266  -0.778   0.800  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        2.842   0.544   0.988  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.512   0.877   0.694  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1        0.904   2.096   0.762  0.00  0.00    -0.232 NA
ATOM      5  C   LIG    1       -0.353   1.907   0.408  0.00  0.00    +0.118 A 
ATOM      6  N   LIG    1       -0.578   0.575   0.057  0.00  0.00    -0.294 N 
ATOM      7  C   LIG    1        0.624  -0.102   0.258  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        1.038  -1.429   0.051  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        2.371  -1.751   0.342  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -1.782  -0.007  -0.414  0.00  0.00    +0.068 A 
ATOM     11  C   LIG    1       -2.212  -1.247   0.079  0.00  0.00    +0.057 A 
ATOM     12  C   LIG    1       -3.386  -1.726  -0.448  0.00  0.00    +0.088 A 
ATOM     13  C   LIG    1       -4.081  -1.007  -1.414  0.00  0.00    +0.158 A 
ATOM     14  N   LIG    1       -5.213  -1.734  -1.740  0.00  0.00    -0.291 N 
ATOM     15  H   LIG    1       -5.907  -1.456  -2.412  0.00  0.00    +0.172 HD
ATOM     16  C   LIG    1       -5.237  -2.907  -0.981  0.00  0.00    +0.326 A 
ATOM     17  O   LIG    1       -6.087  -3.778  -1.007  0.00  0.00    -0.247 OA
ATOM     18  N   LIG    1       -3.709   0.170  -1.919  0.00  0.00    -0.234 NA
ATOM     19  N   LIG    1       -4.088  -2.892  -0.175  0.00  0.00    -0.305 N 
ATOM     20  H   LIG    1       -3.857  -3.621   0.481  0.00  0.00    +0.170 HD
ATOM     21  C   LIG    1       -2.546   0.646  -1.400  0.00  0.00    +0.139 A 
ENDBRANCH   6  10
BRANCH   1  25
ATOM     22  C   LIG    1        6.657  -2.419   0.506  0.00  0.00    +0.128 C 
ATOM     23  N   LIG    1        5.255  -2.112   0.362  0.00  0.00    -0.314 N 
ATOM     24  H   LIG    1        4.802  -2.386  -0.499  0.00  0.00    +0.149 HD
ATOM     25  C   LIG    1        4.681  -1.109   1.117  0.00  0.00    +0.244 C 
ATOM     26  O   LIG    1        5.281  -0.484   1.984  0.00  0.00    -0.270 OA
ENDBRANCH   1  25
BRANCH   5  27
ATOM     27  C   LIG    1       -1.405   2.983   0.517  0.00  0.00    +0.049 C 
ATOM     28  C   LIG    1       -1.136   4.094  -0.499  0.00  0.00    +0.015 C 
ATOM     29  C   LIG    1       -1.428   3.559   1.936  0.00  0.00    +0.015 C 
ENDBRANCH   5  27
TORSDOF 3