REMARK  Name = BDB002429
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.042   1.877  -0.472  0.00  0.00    -0.288 OA
ATOM      2  C   LIG    1        0.632   0.932   0.052  0.00  0.00    +0.200 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        2.082   0.721  -0.249  0.00  0.00    +0.021 A 
ATOM      4  C   LIG    1        2.791  -0.395   0.222  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1        4.147  -0.545  -0.086  0.00  0.00    +0.047 A 
ATOM      6  C   LIG    1        4.789   0.429  -0.848  0.00  0.00    +0.132 A 
ATOM      7  C   LIG    1        4.097   1.529  -1.343  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1        2.743   1.676  -1.037  0.00  0.00    +0.015 A 
BRANCH   6   9
ATOM      9  O   LIG    1        6.133   0.281  -1.202  0.00  0.00    -0.420 OA
BRANCH   9  10
ATOM     10  C   LIG    1        7.033   0.471  -0.153  0.00  0.00    +0.380 C 
ATOM     11  O   LIG    1        6.725   0.751   1.001  0.00  0.00    -0.241 OA
BRANCH  10  12
ATOM     12  C   LIG    1        8.377   0.283  -0.650  0.00  0.00    +0.212 A 
ATOM     13  O   LIG    1        9.422   0.419   0.227  0.00  0.00    -0.456 OA
ATOM     14  C   LIG    1       10.568   0.199  -0.463  0.00  0.00    +0.196 A 
ATOM     15  C   LIG    1       10.291  -0.080  -1.779  0.00  0.00    +0.042 A 
ATOM     16  C   LIG    1        8.881  -0.027  -1.903  0.00  0.00    +0.056 A 
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   2   3
BRANCH   2  17
ATOM     17  C   LIG    1       -0.060  -0.041   0.996  0.00  0.00    +0.311 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -1.404   0.386   1.236  0.00  0.00    -0.456 OA
BRANCH  18  19
ATOM     19  C   LIG    1       -2.167  -0.518   1.907  0.00  0.00    +0.313 C 
ATOM     20  O   LIG    1       -1.754  -1.593   2.319  0.00  0.00    -0.250 OA
BRANCH  19  21
ATOM     21  C   LIG    1       -3.562   0.031   2.112  0.00  0.00    +0.124 C 
ATOM     22  C   LIG    1       -4.237   0.328   0.784  0.00  0.00    +0.123 C 
ATOM     23  N   LIG    1       -4.973  -0.878   0.495  0.00  0.00    -0.293 N 
ATOM     24  C   LIG    1       -5.201  -1.640   1.628  0.00  0.00    +0.217 C 
ATOM     25  O   LIG    1       -5.878  -2.652   1.706  0.00  0.00    -0.276 OA
ATOM     26  C   LIG    1       -4.492  -0.981   2.785  0.00  0.00    +0.112 C 
BRANCH  23  27
ATOM     27  C   LIG    1       -5.677  -1.089  -0.758  0.00  0.00    +0.182 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -6.713  -0.043  -0.962  0.00  0.00    +0.122 A 
ATOM     29  O   LIG    1       -7.768  -0.037  -0.095  0.00  0.00    -0.466 OA
ATOM     30  C   LIG    1       -8.579   0.988  -0.461  0.00  0.00    +0.195 A 
ATOM     31  C   LIG    1       -8.062   1.645  -1.552  0.00  0.00    +0.041 A 
ATOM     32  C   LIG    1       -6.855   0.980  -1.878  0.00  0.00    +0.046 A 
ENDBRANCH  27  28
ENDBRANCH  23  27
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   2  17
TORSDOF 10