REMARK  Name = BDB000836
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.443   2.121  -0.285  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -3.003   1.706  -0.377  0.00  0.00    -0.048 A 
ATOM      3  C   LIG    1       -2.627   0.385  -0.086  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1       -1.289  -0.004  -0.203  0.00  0.00    +0.074 A 
ATOM      5  C   LIG    1       -0.309   0.919  -0.623  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1        1.060   0.603  -0.767  0.00  0.00    -0.227 NA
ATOM      7  C   LIG    1        1.476  -0.607  -0.509  0.00  0.00    +0.163 A 
ATOM      8  C   LIG    1        0.516  -1.597  -0.065  0.00  0.00    +0.179 A 
ATOM      9  N   LIG    1        0.812  -2.840   0.259  0.00  0.00    -0.233 NA
ATOM     10  C   LIG    1       -0.387  -3.389   0.613  0.00  0.00    +0.134 A 
ATOM     11  C   LIG    1       -1.423  -2.476   0.516  0.00  0.00    +0.041 A 
ATOM     12  C   LIG    1       -2.857  -2.690   0.813  0.00  0.00    +0.065 C 
ATOM     13  C   LIG    1       -0.700   2.225  -0.922  0.00  0.00    +0.030 A 
ATOM     14  N   LIG    1       -0.820  -1.306   0.080  0.00  0.00    -0.292 N 
ATOM     15  C   LIG    1       -2.034   2.618  -0.807  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   7  16
ATOM     16  N   LIG    1        2.806  -0.944  -0.648  0.00  0.00    -0.325 N 
ATOM     17  H   LIG    1        3.033  -1.849  -0.241  0.00  0.00    +0.148 HD
BRANCH  16  18
ATOM     18  C   LIG    1        3.873   0.035  -0.662  0.00  0.00    +0.118 C 
BRANCH  18  19
ATOM     19  C   LIG    1        4.143   0.591   0.749  0.00  0.00    +0.096 C 
BRANCH  19  20
ATOM     20  N   LIG    1        5.259   1.540   0.794  0.00  0.00    -0.329 NA
ATOM     21  H   LIG    1        6.094   1.112   0.397  0.00  0.00    +0.118 HD
ATOM     22  H   LIG    1        5.040   2.342   0.203  0.00  0.00    +0.118 HD
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH   7  16
TORSDOF 4