REMARK  Name = BDB027701
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.479  -0.745  -0.401  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -0.230  -2.006  -0.966  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.102  -2.419  -0.928  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        1.371  -3.657  -1.492  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.461  -4.491  -2.062  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.815  -4.070  -2.066  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.081  -1.683  -0.381  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.737  -0.505   0.162  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -1.208  -2.854  -1.539  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.488  -0.013   0.173  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.801   0.308   0.778  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        4.136  -0.124   0.803  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        5.102   0.676   1.393  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.842   1.871   1.958  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.559   2.283   1.934  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        2.526   1.552   1.368  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.805  -0.228  -0.397  0.00  0.00    -0.321 N 
ATOM     18  H   LIG    1       -2.155  -0.282  -1.352  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.175   1.043   0.224  0.00  0.00    +0.056 C 
ATOM     20  C   LIG    1       -1.589   2.285  -0.506  0.00  0.00    +0.028 C 
ATOM     21  C   LIG    1       -2.863   2.333  -1.370  0.00  0.00    +0.004 C 
ATOM     22  C   LIG    1       -3.575   1.507  -0.284  0.00  0.00    +0.028 C 
BRANCH  19  23
ATOM     23  C   LIG    1       -2.059   0.995   1.747  0.00  0.00    +0.181 C 
BRANCH  23  24
ATOM     24  O   LIG    1       -2.778  -0.135   2.244  0.00  0.00    -0.393 OA
ATOM     25  H   LIG    1       -2.483  -0.882   1.690  0.00  0.00    +0.209 HD
ENDBRANCH  23  24
ENDBRANCH  19  23
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 5