REMARK  Name = BDB009010
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.525  -0.528  -0.781  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.171   0.660  -0.515  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -1.124   1.166  -1.415  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -1.353   0.479  -2.612  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.664  -0.701  -2.885  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        0.267  -1.204  -1.973  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        2.252  -2.952  -0.721  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1        2.253  -2.089   0.151  0.00  0.00    +0.218 C 
ATOM      9  N   LIG    1        1.454  -0.958   0.189  0.00  0.00    -0.285 N 
ATOM     10  H   LIG    1        1.556  -0.354   0.994  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1        3.131  -2.210   1.389  0.00  0.00    +0.101 C 
BRANCH  11  12
ATOM     12  C   LIG    1        4.464  -2.896   1.097  0.00  0.00    +0.044 C 
BRANCH  12  13
ATOM     13  C   LIG    1        5.436  -1.972   0.400  0.00  0.00    -0.047 A 
ATOM     14  C   LIG    1        5.486  -1.918  -0.999  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        6.365  -1.046  -1.642  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        7.201  -0.218  -0.894  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        7.159  -0.263   0.498  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        6.279  -1.134   1.143  0.00  0.00    +0.003 A 
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  19
ATOM     19  C   LIG    1       -1.862   2.451  -1.118  0.00  0.00    +0.092 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.523   2.468   0.258  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1       -3.770   1.672   0.493  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1       -4.406   0.881  -0.616  0.00  0.00    +0.037 C 
ATOM     23  C   LIG    1       -5.822   0.399  -0.285  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -5.899  -0.145   1.135  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -5.497   0.924   2.153  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -4.278   1.701   1.737  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -3.624   2.516   2.791  0.00  0.00    +0.268 A 
ATOM     28  O   LIG    1       -4.068   2.577   3.933  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -2.498   3.194   2.411  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -2.039   3.761   3.116  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -1.936   3.181   1.174  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 6