REMARK  Name = BDB018270
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.065  -0.146   0.509  0.00  0.00    +0.024 A 
ATOM      2  C   LIG    1       -0.288   0.934   0.870  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1        0.693   0.444   1.687  0.00  0.00    -0.267 N 
ATOM      4  N   LIG    1        0.604  -0.887   1.889  0.00  0.00    -0.179 NA
ATOM      5  C   LIG    1       -0.468  -1.241   1.172  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -3.429  -0.900  -0.075  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -2.209  -0.126  -0.361  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -2.190   0.611  -1.492  0.00  0.00    +0.101 A 
ATOM      9  N   LIG    1       -3.253   0.660  -2.377  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -3.121   1.475  -3.575  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -4.420  -0.058  -2.168  0.00  0.00    +0.255 A 
ATOM     12  O   LIG    1       -5.391  -0.065  -2.919  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -4.467  -0.869  -0.927  0.00  0.00    +0.116 A 
BRANCH   6  14
ATOM     14  O   LIG    1       -3.387  -1.601   1.112  0.00  0.00    -0.491 OA
BRANCH  14  16
ATOM     15  C   LIG    1       -5.516  -1.497   2.273  0.00  0.00    +0.048 C 
ATOM     16  C   LIG    1       -4.509  -2.369   1.543  0.00  0.00    +0.226 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1        1.746   1.210   2.341  0.00  0.00    +0.178 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.811   1.642   1.362  0.00  0.00    -0.025 A 
ATOM     19  C   LIG    1        3.648   0.689   0.754  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        4.637   1.082  -0.159  0.00  0.00    +0.059 A 
ATOM     21  C   LIG    1        4.789   2.441  -0.462  0.00  0.00    +0.015 A 
ATOM     22  C   LIG    1        3.966   3.394   0.139  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        2.983   2.998   1.046  0.00  0.00    +0.005 A 
BRANCH  20  24
ATOM     24  C   LIG    1        5.541   0.109  -0.830  0.00  0.00    +0.339 C 
ATOM     25  O   LIG    1        6.384   0.430  -1.654  0.00  0.00    -0.245 OA
BRANCH  24  26
ATOM     26  O   LIG    1        5.296  -1.152  -0.397  0.00  0.00    -0.464 OA
ATOM     27  C   LIG    1        6.124  -2.147  -1.000  0.00  0.00    +0.280 C 
ENDBRANCH  24  26
ENDBRANCH  20  24
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 7