REMARK  Name = BDB014305
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.577   0.787  -0.062  0.00  0.00    +0.146 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.341  -0.348  -0.705  0.00  0.00    +0.011 A 
ATOM      3  C   LIG    1        2.205  -1.174   0.030  0.00  0.00    +0.125 A 
ATOM      4  C   LIG    1        2.852  -2.249  -0.588  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.691  -2.474  -1.954  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        1.864  -1.640  -2.703  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        1.188  -0.590  -2.081  0.00  0.00    +0.009 A 
BRANCH   3   8
ATOM      8  O   LIG    1        2.337  -0.944   1.376  0.00  0.00    -0.492 OA
BRANCH   8   9
ATOM      9  C   LIG    1        3.693  -0.731   1.798  0.00  0.00    +0.229 C 
BRANCH   9  10
ATOM     10  C   LIG    1        4.133   0.705   1.502  0.00  0.00    +0.045 C 
BRANCH  10  11
ATOM     11  C   LIG    1        5.576   0.984   1.928  0.00  0.00    +0.031 C 
BRANCH  11  12
ATOM     12  C   LIG    1        6.683   0.344   1.131  0.00  0.00    -0.020 C 
ATOM     13  C   LIG    1        6.577  -0.278  -0.056  0.00  0.00    +0.087 C 
BRANCH  13  14
ATOM     14  C   LIG    1        7.709  -0.884  -0.776  0.00  0.00    +0.329 C 
ATOM     15  O   LIG    1        7.612  -1.472  -1.838  0.00  0.00    -0.246 OA
BRANCH  14  16
ATOM     16  O   LIG    1        8.889  -0.741  -0.155  0.00  0.00    -0.478 OA
ATOM     17  H   LIG    1        9.522  -1.185  -0.755  0.00  0.00    +0.295 HD
ENDBRANCH  14  16
ENDBRANCH  13  14
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   3   8
ENDBRANCH   1   2
BRANCH   1  19
ATOM     18  C   LIG    1       -1.250  -0.442   1.088  0.00  0.00    +0.132 C 
ATOM     19  N   LIG    1       -0.855   0.517   0.061  0.00  0.00    -0.296 N 
ATOM     20  C   LIG    1       -1.720   1.108  -0.854  0.00  0.00    +0.247 C 
ATOM     21  O   LIG    1       -1.347   1.750  -1.834  0.00  0.00    -0.270 OA
BRANCH  20  22
ATOM     22  C   LIG    1       -3.179   0.983  -0.651  0.00  0.00    +0.037 A 
ATOM     23  C   LIG    1       -3.781   1.467   0.513  0.00  0.00    +0.014 A 
ATOM     24  C   LIG    1       -5.167   1.363   0.670  0.00  0.00    +0.012 A 
ATOM     25  C   LIG    1       -5.969   0.792  -0.333  0.00  0.00    +0.017 A 
ATOM     26  C   LIG    1       -5.346   0.335  -1.506  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1       -3.960   0.436  -1.670  0.00  0.00    +0.014 A 
BRANCH  25  28
ATOM     28  C   LIG    1       -7.418   0.681  -0.171  0.00  0.00    +0.135 A 
ATOM     29  O   LIG    1       -7.930   1.103   1.026  0.00  0.00    -0.463 OA
ATOM     30  C   LIG    1       -9.274   0.921   0.983  0.00  0.00    +0.196 A 
ATOM     31  C   LIG    1       -9.647   0.385  -0.226  0.00  0.00    +0.042 A 
ATOM     32  C   LIG    1       -8.452   0.229  -0.970  0.00  0.00    +0.050 A 
ENDBRANCH  25  28
ENDBRANCH  20  22
ENDBRANCH   1  19
TORSDOF 11