REMARK  Name = BDB015014
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.636   1.883  -1.658  0.00  0.00    +0.192 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.767   1.762  -0.620  0.00  0.00    +0.154 C 
BRANCH   2   3
ATOM      3  O   LIG    1        1.882   3.021   0.060  0.00  0.00    -0.388 OA
ATOM      4  H   LIG    1        1.075   3.132   0.593  0.00  0.00    +0.210 HD
ENDBRANCH   2   3
BRANCH   2   5
ATOM      5  C   LIG    1        3.112   1.396  -1.295  0.00  0.00    +0.118 C 
BRANCH   5   6
ATOM      6  N   LIG    1        4.107   0.772  -0.388  0.00  0.00    -0.295 NA
ATOM      7  C   LIG    1        5.250   0.285  -1.191  0.00  0.00    +0.120 C 
ATOM      8  C   LIG    1        6.406  -0.241  -0.367  0.00  0.00    -0.030 A 
ATOM      9  C   LIG    1        6.565   0.139   0.975  0.00  0.00    -0.042 A 
ATOM     10  C   LIG    1        7.664  -0.330   1.708  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1        8.616  -1.150   1.102  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1        8.473  -1.513  -0.235  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        5.518   0.992   1.640  0.00  0.00    +0.051 C 
ATOM     14  C   LIG    1        7.375  -1.060  -0.967  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1        4.599   1.708   0.637  0.00  0.00    +0.089 C 
ENDBRANCH   5   6
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  O   LIG    1        0.393   0.711  -2.436  0.00  0.00    -0.373 OA
BRANCH  16  17
ATOM     17  C   LIG    1       -0.080  -0.422  -1.705  0.00  0.00    +0.195 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.456  -0.214  -1.123  0.00  0.00    -0.022 A 
ATOM     19  C   LIG    1       -2.519   0.187  -1.943  0.00  0.00    +0.006 A 
ATOM     20  C   LIG    1       -3.797   0.374  -1.410  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -4.037   0.157  -0.047  0.00  0.00    -0.033 A 
ATOM     22  C   LIG    1       -2.973  -0.248   0.771  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -1.695  -0.436   0.239  0.00  0.00    +0.006 A 
BRANCH  21  24
ATOM     24  C   LIG    1       -5.419   0.367   0.537  0.00  0.00    +0.119 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -5.974  -0.839   1.171  0.00  0.00    -0.294 NA
ATOM     26  C   LIG    1       -6.181  -1.925   0.184  0.00  0.00    +0.113 C 
ATOM     27  C   LIG    1       -7.261  -2.917   0.641  0.00  0.00    +0.175 C 
ATOM     28  O   LIG    1       -8.556  -2.308   0.754  0.00  0.00    -0.377 OA
ATOM     29  C   LIG    1       -8.494  -0.918   1.099  0.00  0.00    +0.175 C 
ATOM     30  C   LIG    1       -7.232  -0.546   1.892  0.00  0.00    +0.113 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 9