REMARK  Name = BDB065095
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.796   0.008  -0.218  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1       -4.895  -1.068  -0.212  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1       -3.563  -0.836   0.136  0.00  0.00    +0.062 A 
ATOM      4  C   LIG    1       -3.111   0.464   0.478  0.00  0.00    +0.044 A 
ATOM      5  C   LIG    1       -4.013   1.534   0.446  0.00  0.00    +0.081 A 
ATOM      6  N   LIG    1       -3.653   2.788   0.730  0.00  0.00    -0.218 NA
ATOM      7  C   LIG    1       -2.363   2.986   1.043  0.00  0.00    +0.234 A 
ATOM      8  N   LIG    1       -1.414   2.042   1.120  0.00  0.00    -0.203 NA
ATOM      9  C   LIG    1       -1.789   0.784   0.847  0.00  0.00    +0.131 A 
ATOM     10  C   LIG    1       -5.337   1.290   0.106  0.00  0.00    +0.078 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -8.031   0.774  -0.589  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1       -7.091  -0.291  -0.558  0.00  0.00    -0.491 OA
ENDBRANCH   1  12
BRANCH   2  13
ATOM     13  O   LIG    1       -5.409  -2.294  -0.547  0.00  0.00    -0.491 OA
ATOM     14  C   LIG    1       -4.497  -3.370  -0.720  0.00  0.00    +0.277 C 
ENDBRANCH   2  13
BRANCH   7  15
ATOM     15  C   LIG    1       -1.962   4.336   1.342  0.00  0.00    +0.140 C 
ATOM     16  N   LIG    1       -1.636   5.425   1.589  0.00  0.00    -0.188 NA
ENDBRANCH   7  15
BRANCH   9  17
ATOM     17  N   LIG    1       -0.831  -0.250   0.932  0.00  0.00    -0.326 N 
ATOM     18  H   LIG    1       -1.179  -0.931   1.604  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        0.561   0.145   1.224  0.00  0.00    +0.074 C 
ATOM     20  C   LIG    1        1.205   0.787  -0.017  0.00  0.00    +0.037 C 
ATOM     21  C   LIG    1        2.715   0.566  -0.028  0.00  0.00    +0.086 C 
ATOM     22  N   LIG    1        3.067  -0.860  -0.130  0.00  0.00    -0.298 NA
ATOM     23  C   LIG    1        2.094  -1.748   0.518  0.00  0.00    +0.086 C 
ATOM     24  C   LIG    1        1.356  -1.094   1.682  0.00  0.00    +0.037 C 
BRANCH  22  25
ATOM     25  C   LIG    1        4.443  -1.119   0.329  0.00  0.00    +0.119 C 
BRANCH  25  26
ATOM     26  C   LIG    1        5.501  -0.411  -0.491  0.00  0.00    -0.033 A 
ATOM     27  C   LIG    1        6.386   0.495   0.111  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        7.367   1.136  -0.648  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.475   0.878  -2.014  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.603  -0.022  -2.623  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        5.622  -0.665  -1.866  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH  17  19
ENDBRANCH   9  17
TORSDOF 7