REMARK  Name = BDB051288
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.106  -0.427   0.056  0.00  0.00    +0.099 A 
ATOM      2  N   LIG    1        0.818  -0.125   0.989  0.00  0.00    -0.164 NA
ATOM      3  N   LIG    1        1.999  -0.328   0.372  0.00  0.00    -0.215 N 
ATOM      4  C   LIG    1        1.860  -0.766  -0.919  0.00  0.00    +0.138 A 
ATOM      5  N   LIG    1        2.952  -1.037  -1.711  0.00  0.00    -0.307 N 
ATOM      6  H   LIG    1        2.845  -1.361  -2.664  0.00  0.00    +0.170 HD
ATOM      7  C   LIG    1        4.235  -0.870  -1.226  0.00  0.00    +0.259 A 
ATOM      8  C   LIG    1        4.382  -0.391   0.182  0.00  0.00    +0.065 A 
ATOM      9  C   LIG    1        5.654  -0.204   0.729  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        5.786   0.245   2.047  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        4.651   0.507   2.821  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        3.375   0.325   2.286  0.00  0.00    +0.028 A 
ATOM     13  O   LIG    1        5.217  -1.106  -1.922  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1        3.252  -0.124   0.969  0.00  0.00    +0.080 A 
ATOM     15  C   LIG    1        0.514  -0.848  -1.157  0.00  0.00    +0.076 A 
ENDROOT
BRANCH   1  18
ATOM     16  C   LIG    1       -3.872   0.052  -0.309  0.00  0.00    +0.162 A 
ATOM     17  C   LIG    1       -2.495   0.032  -0.617  0.00  0.00    +0.171 A 
ATOM     18  C   LIG    1       -1.540  -0.331   0.352  0.00  0.00    +0.047 A 
ATOM     19  C   LIG    1       -1.985  -0.613   1.653  0.00  0.00    +0.014 A 
ATOM     20  C   LIG    1       -3.342  -0.565   1.972  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1       -4.283  -0.241   0.993  0.00  0.00    +0.049 A 
BRANCH  16  23
ATOM     22  C   LIG    1       -6.115   0.277  -1.094  0.00  0.00    +0.277 C 
ATOM     23  O   LIG    1       -4.719   0.373  -1.340  0.00  0.00    -0.491 OA
ENDBRANCH  16  23
BRANCH  17  24
ATOM     24  O   LIG    1       -2.092   0.331  -1.901  0.00  0.00    -0.491 OA
ATOM     25  C   LIG    1       -1.995   1.747  -2.065  0.00  0.00    +0.277 C 
ENDBRANCH  17  24
ENDBRANCH   1  18
TORSDOF 3