REMARK  Name = BDB006837
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.670   0.565   0.180  0.00  0.00    -0.043 A 
ATOM      2  C   LIG    1       -2.363   0.276  -0.254  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -1.646  -0.732   0.372  0.00  0.00    +0.040 A 
ATOM      4  N   LIG    1       -0.338  -1.188   0.116  0.00  0.00    -0.270 N 
ATOM      5  C   LIG    1       -0.003  -2.208   1.125  0.00  0.00    +0.118 C 
ATOM      6  C   LIG    1       -1.282  -2.520   1.911  0.00  0.00    +0.056 C 
ATOM      7  C   LIG    1        0.526  -0.682  -0.843  0.00  0.00    +0.234 C 
ATOM      8  O   LIG    1        0.250   0.241  -1.615  0.00  0.00    -0.274 OA
ATOM      9  C   LIG    1       -2.212  -1.460   1.418  0.00  0.00    -0.024 A 
ATOM     10  C   LIG    1       -3.499  -1.202   1.862  0.00  0.00    +0.006 A 
ATOM     11  C   LIG    1       -4.224  -0.183   1.240  0.00  0.00    +0.004 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1       -5.715   1.131  -1.184  0.00  0.00    +0.012 C 
ATOM     13  C   LIG    1       -4.455   1.672  -0.504  0.00  0.00    +0.013 C 
ATOM     14  C   LIG    1       -4.802   2.800   0.471  0.00  0.00    +0.012 C 
ENDBRANCH   1  13
BRANCH   7  15
ATOM     15  C   LIG    1        1.913  -1.343  -0.938  0.00  0.00    +0.181 C 
BRANCH  15  16
ATOM     16  N   LIG    1        2.778  -0.996   0.216  0.00  0.00    -0.291 NA
ATOM     17  C   LIG    1        3.030   0.462   0.286  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1        3.851   1.039  -0.907  0.00  0.00    +0.065 C 
ATOM     19  C   LIG    1        4.432   2.406  -0.539  0.00  0.00    +0.025 C 
ATOM     20  N   LIG    1        4.910   0.136  -1.406  0.00  0.00    -0.311 NA
ATOM     21  H   LIG    1        5.728   0.668  -1.698  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1        5.278  -0.863  -0.403  0.00  0.00    +0.096 C 
ATOM     23  C   LIG    1        4.078  -1.703   0.105  0.00  0.00    +0.100 C 
ENDBRANCH  15  16
ENDBRANCH   7  15
TORSDOF 3