REMARK  Name = BDB014425
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.873   2.330  -0.372  0.00  0.00    +0.136 C 
ENDROOT
BRANCH   1   3
ATOM      2  C   LIG    1        2.904   1.240  -1.261  0.00  0.00    +0.254 C 
ATOM      3  N   LIG    1        1.528   1.372  -1.247  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1        0.997   1.121  -2.075  0.00  0.00    +0.149 HD
ATOM      5  O   LIG    1        3.622   1.789  -0.431  0.00  0.00    -0.272 OA
BRANCH   2   7
ATOM      6  C   LIG    1        3.361   1.092  -3.709  0.00  0.00    +0.062 C 
ATOM      7  C   LIG    1        3.433   0.326  -2.388  0.00  0.00    +0.255 C 
BRANCH   7   8
ATOM      8  O   LIG    1        4.788  -0.077  -2.227  0.00  0.00    -0.480 OA
BRANCH   8   9
ATOM      9  C   LIG    1        5.060  -1.124  -1.391  0.00  0.00    +0.122 A 
ATOM     10  C   LIG    1        4.163  -1.743  -0.519  0.00  0.00    +0.045 A 
ATOM     11  C   LIG    1        4.584  -2.811   0.281  0.00  0.00    +0.004 A 
ATOM     12  C   LIG    1        5.902  -3.261   0.217  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        6.804  -2.641  -0.643  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        6.382  -1.575  -1.440  0.00  0.00    +0.045 A 
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   2   7
ENDBRANCH   1   3
BRANCH   1  15
ATOM     15  C   LIG    1       -0.613   2.004  -0.185  0.00  0.00    +0.145 C 
BRANCH  15  16
ATOM     16  O   LIG    1       -1.221   1.809  -1.474  0.00  0.00    -0.389 OA
ATOM     17  H   LIG    1       -2.042   1.307  -1.281  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
BRANCH  15  18
ATOM     18  C   LIG    1       -0.831   0.736   0.670  0.00  0.00    +0.117 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -2.258   0.331   0.694  0.00  0.00    -0.295 NA
ATOM     20  C   LIG    1       -3.071   1.263   1.507  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1       -4.498   0.802   1.718  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1       -4.850  -0.550   1.571  0.00  0.00    -0.042 A 
ATOM     23  C   LIG    1       -6.171  -0.956   1.803  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -7.132  -0.029   2.205  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.783   1.309   2.370  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -3.823  -1.547   1.102  0.00  0.00    +0.051 C 
ATOM     27  C   LIG    1       -5.472   1.723   2.132  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -2.387  -1.028   1.254  0.00  0.00    +0.089 C 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 8