REMARK  Name = BDB018378
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.596  -0.139  -0.560  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1        0.545  -0.676  -0.003  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1        1.615   0.104  -0.408  0.00  0.00    -0.238 N 
ATOM      4  N   LIG    1        1.194   1.097  -1.220  0.00  0.00    -0.174 NA
ATOM      5  C   LIG    1       -0.128   0.958  -1.298  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -3.080   0.277  -0.185  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -1.939  -0.628  -0.407  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -2.197  -1.950  -0.474  0.00  0.00    +0.101 A 
ATOM      9  N   LIG    1       -3.471  -2.476  -0.349  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -3.641  -3.917  -0.452  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -4.585  -1.673  -0.153  0.00  0.00    +0.255 A 
ATOM     12  O   LIG    1       -5.739  -2.078  -0.046  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -4.325  -0.216  -0.069  0.00  0.00    +0.116 A 
BRANCH   6  14
ATOM     14  O   LIG    1       -2.733   1.608  -0.096  0.00  0.00    -0.491 OA
BRANCH  14  16
ATOM     15  C   LIG    1       -4.009   2.746   1.628  0.00  0.00    +0.048 C 
ATOM     16  C   LIG    1       -3.726   2.605   0.142  0.00  0.00    +0.226 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1        2.996  -0.047  -0.060  0.00  0.00    +0.083 A 
ATOM     18  C   LIG    1        4.015   0.774  -0.607  0.00  0.00    +0.080 A 
ATOM     19  C   LIG    1        5.364   0.572  -0.206  0.00  0.00    -0.031 A 
ATOM     20  C   LIG    1        6.489   1.417  -0.757  0.00  0.00    +0.045 C 
ATOM     21  C   LIG    1        5.678  -0.433   0.718  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1        4.679  -1.237   1.250  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1        3.351  -1.048   0.867  0.00  0.00    +0.029 A 
BRANCH  18  24
ATOM     24  C   LIG    1        3.771   1.815  -1.579  0.00  0.00    +0.102 C 
ATOM     25  N   LIG    1        3.698   2.667  -2.367  0.00  0.00    -0.191 NA
ENDBRANCH  18  24
ENDBRANCH   3  17
TORSDOF 5