REMARK  Name = BDB007756
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.805   0.612   0.607  0.00  0.00    +0.263 C 
ATOM      2  N   LIG    1        0.333  -0.115   0.874  0.00  0.00    -0.308 N 
ATOM      3  H   LIG    1        0.201  -1.009   1.345  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -0.806   1.778   0.232  0.00  0.00    -0.269 OA
ENDROOT
BRANCH   1   9
ATOM      5  C   LIG    1       -4.417  -0.257   0.765  0.00  0.00    +0.123 A 
ATOM      6  N   LIG    1       -4.358  -1.518   1.227  0.00  0.00    -0.221 NA
ATOM      7  C   LIG    1       -3.141  -2.031   1.456  0.00  0.00    +0.224 A 
ATOM      8  N   LIG    1       -1.976  -1.405   1.271  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1       -2.086  -0.135   0.817  0.00  0.00    +0.130 A 
ATOM     10  C   LIG    1       -3.283   0.493   0.552  0.00  0.00    +0.076 A 
BRANCH   5  11
ATOM     11  N   LIG    1       -5.677   0.341   0.542  0.00  0.00    -0.323 N 
ATOM     12  H   LIG    1       -5.668   0.806  -0.365  0.00  0.00    +0.148 HD
BRANCH  11  17
ATOM     13  C   LIG    1      -10.133   0.749  -1.860  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1       -9.101  -0.347  -1.880  0.00  0.00    +0.213 C 
ATOM     15  N   LIG    1       -8.130  -0.250  -0.920  0.00  0.00    -0.298 N 
ATOM     16  C   LIG    1       -7.255  -1.324  -0.458  0.00  0.00    +0.131 C 
ATOM     17  C   LIG    1       -6.907  -0.406   0.731  0.00  0.00    +0.106 C 
ATOM     18  C   LIG    1       -8.157   0.423   0.372  0.00  0.00    +0.131 C 
ATOM     19  O   LIG    1       -9.143  -1.263  -2.698  0.00  0.00    -0.276 OA
ENDBRANCH  11  17
ENDBRANCH   5  11
ENDBRANCH   1   9
BRANCH   2  20
ATOM     20  C   LIG    1        1.647   0.496   0.966  0.00  0.00    +0.137 C 
BRANCH  20  21
ATOM     21  C   LIG    1        2.753  -0.554   0.796  0.00  0.00    +0.145 C 
BRANCH  21  22
ATOM     22  O   LIG    1        2.567  -1.578   1.793  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1        3.242  -2.261   1.631  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1        4.165   0.053   0.953  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1        4.505   1.135   0.014  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1        5.820   1.728   0.333  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1        7.012   0.905  -0.112  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1        6.893  -0.037  -1.151  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1        8.019  -0.759  -1.568  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1        9.260  -0.533  -0.973  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        9.385   0.411   0.044  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        5.548  -0.315  -1.775  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1        8.268   1.129   0.470  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1        4.494   0.739  -1.404  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 8