REMARK  Name = BDB009081
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.411   1.469  -0.168  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        0.292   1.375   0.662  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -0.832   2.194   0.455  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -0.809   3.132  -0.584  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        0.307   3.239  -1.410  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        1.412   2.410  -1.203  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        2.782  -0.357   0.873  0.00  0.00    +0.268 C 
ATOM      8  N   LIG    1        2.557   0.667  -0.027  0.00  0.00    -0.280 N 
ATOM      9  H   LIG    1        3.330   0.836  -0.669  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        2.011  -0.780   1.726  0.00  0.00    -0.268 OA
BRANCH   7  15
ATOM     11  C   LIG    1        7.908  -2.734   0.319  0.00  0.00    +0.067 C 
ATOM     12  C   LIG    1        6.554  -2.116   0.475  0.00  0.00    +0.056 A 
ATOM     13  N   LIG    1        5.741  -2.604   1.446  0.00  0.00    -0.256 NA
ATOM     14  C   LIG    1        4.523  -2.014   1.553  0.00  0.00    +0.144 A 
ATOM     15  C   LIG    1        4.130  -0.977   0.722  0.00  0.00    +0.144 A 
ATOM     16  N   LIG    1        4.937  -0.476  -0.260  0.00  0.00    -0.247 NA
ATOM     17  C   LIG    1        6.150  -1.073  -0.355  0.00  0.00    +0.134 A 
ENDBRANCH   7  15
ENDBRANCH   1   8
BRANCH   3  18
ATOM     18  C   LIG    1       -2.036   2.079   1.360  0.00  0.00    +0.092 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.323   1.746   0.610  0.00  0.00    +0.069 A 
ATOM     20  C   LIG    1       -3.561   0.350   0.123  0.00  0.00    -0.016 A 
ATOM     21  C   LIG    1       -2.575  -0.750   0.404  0.00  0.00    +0.037 C 
ATOM     22  C   LIG    1       -3.139  -2.151   0.145  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -3.913  -2.195  -1.166  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -5.073  -1.196  -1.152  0.00  0.00    +0.041 C 
ATOM     25  C   LIG    1       -4.696   0.136  -0.565  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1       -5.655   1.248  -0.784  0.00  0.00    +0.268 A 
ATOM     27  O   LIG    1       -6.707   1.085  -1.395  0.00  0.00    -0.266 OA
ATOM     28  N   LIG    1       -5.298   2.459  -0.258  0.00  0.00    -0.243 N 
ATOM     29  H   LIG    1       -5.940   3.232  -0.397  0.00  0.00    +0.192 HD
ATOM     30  N   LIG    1       -4.154   2.729   0.423  0.00  0.00    -0.175 NA
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 4