REMARK  Name = BDB001798
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.992  -0.744   1.364  0.00  0.00    +0.285 C 
ATOM      2  N   LIG    1        0.151  -0.589   0.558  0.00  0.00    -0.162 N 
ATOM      3  C   LIG    1        0.301  -0.631  -0.828  0.00  0.00    +0.219 A 
ATOM      4  N   LIG    1        1.545  -0.366  -1.141  0.00  0.00    -0.193 NA
ATOM      5  C   LIG    1        2.177  -0.230   0.072  0.00  0.00    +0.185 A 
ATOM      6  N   LIG    1        1.378  -0.409   1.129  0.00  0.00    -0.141 NA
ATOM      7  O   LIG    1       -0.845  -0.973   2.566  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   1   9
ATOM      8  C   LIG    1       -2.849   0.433   0.161  0.00  0.00    +0.132 A 
ATOM      9  C   LIG    1       -2.378  -0.691   0.857  0.00  0.00    +0.083 A 
ATOM     10  C   LIG    1       -3.215  -1.784   1.118  0.00  0.00    +0.017 A 
ATOM     11  C   LIG    1       -4.525  -1.777   0.646  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -4.996  -0.678  -0.070  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -4.166   0.425  -0.307  0.00  0.00    +0.046 A 
BRANCH   8  15
ATOM     14  C   LIG    1       -2.378   2.566  -0.799  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1       -1.973   1.474   0.018  0.00  0.00    -0.494 OA
ENDBRANCH   8  15
ENDBRANCH   1   9
BRANCH   5  16
ATOM     16  C   LIG    1        3.598   0.058   0.172  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1        4.233   0.171   1.405  0.00  0.00    +0.122 A 
ATOM     18  N   LIG    1        5.556   0.439   1.564  0.00  0.00    -0.263 NA
ATOM     19  C   LIG    1        6.280   0.602   0.437  0.00  0.00    +0.111 A 
ATOM     20  C   LIG    1        5.748   0.511  -0.839  0.00  0.00    +0.020 A 
ATOM     21  C   LIG    1        4.387   0.235  -0.969  0.00  0.00    +0.014 A 
ENDBRANCH   5  16
BRANCH   3  22
ATOM     22  N   LIG    1       -0.656  -0.947  -1.729  0.00  0.00    -0.327 N 
ATOM     23  H   LIG    1       -1.406  -1.586  -1.485  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -0.304  -1.123  -2.668  0.00  0.00    +0.145 HD
ENDBRANCH   3  22
TORSDOF 4