REMARK  Name = BDB014988
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.682  -2.482  -0.917  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.837  -2.642  -1.913  0.00  0.00    +0.166 C 
BRANCH   2   3
ATOM      3  O   LIG    1       -1.820  -3.981  -2.441  0.00  0.00    -0.387 OA
ATOM      4  H   LIG    1       -0.895  -4.140  -2.713  0.00  0.00    +0.210 HD
ENDBRANCH   2   3
BRANCH   2   5
ATOM      5  C   LIG    1       -3.212  -2.393  -1.265  0.00  0.00    +0.119 C 
BRANCH   5   6
ATOM      6  N   LIG    1       -3.374  -1.073  -0.630  0.00  0.00    -0.295 NA
ATOM      7  C   LIG    1       -4.602  -1.066   0.194  0.00  0.00    +0.120 C 
ATOM      8  C   LIG    1       -4.940   0.290   0.776  0.00  0.00    -0.030 A 
ATOM      9  C   LIG    1       -4.420   1.467   0.212  0.00  0.00    -0.042 A 
ATOM     10  C   LIG    1       -4.772   2.713   0.749  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -5.656   2.791   1.824  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -6.189   1.627   2.374  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -3.437   1.383  -0.926  0.00  0.00    +0.051 C 
ATOM     14  C   LIG    1       -5.835   0.383   1.852  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1       -3.451   0.013  -1.621  0.00  0.00    +0.089 C 
ENDBRANCH   5   6
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  O   LIG    1        0.540  -2.752  -1.634  0.00  0.00    -0.489 OA
BRANCH  16  17
ATOM     17  C   LIG    1        1.615  -2.552  -0.813  0.00  0.00    +0.124 A 
ATOM     18  C   LIG    1        2.244  -1.309  -0.797  0.00  0.00    +0.091 A 
ATOM     19  C   LIG    1        3.361  -1.099   0.014  0.00  0.00    +0.124 A 
ATOM     20  C   LIG    1        3.848  -2.152   0.793  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1        3.225  -3.405   0.754  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1        2.109  -3.609  -0.056  0.00  0.00    +0.046 A 
BRANCH  19  23
ATOM     23  O   LIG    1        3.879   0.165  -0.047  0.00  0.00    -0.487 OA
BRANCH  23  24
ATOM     24  C   LIG    1        5.013   0.444   0.769  0.00  0.00    +0.264 C 
BRANCH  24  25
ATOM     25  C   LIG    1        5.398   1.887   0.561  0.00  0.00    -0.010 A 
ATOM     26  C   LIG    1        6.361   2.238  -0.396  0.00  0.00    +0.007 A 
ATOM     27  C   LIG    1        6.706   3.576  -0.595  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        6.087   4.576   0.152  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.117   4.240   1.095  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        4.770   2.903   1.296  0.00  0.00    +0.007 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  19  23
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 9