REMARK  Name = BDB009083
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.433   0.215  -1.753  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.658  -0.624  -1.511  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -1.806  -0.571  -2.323  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -1.829   0.311  -3.411  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.742   1.143  -3.665  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        0.382   1.097  -2.840  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        1.058  -1.167   0.817  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.847  -0.473   0.190  0.00  0.00    +0.248 C 
ATOM      9  N   LIG    1        1.609   0.225  -0.975  0.00  0.00    -0.282 N 
ATOM     10  H   LIG    1        2.333   0.862  -1.280  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1        3.211  -0.252   0.743  0.00  0.00    +0.052 C 
ATOM     12  C   LIG    1        3.285  -0.089   2.232  0.00  0.00    +0.269 C 
ATOM     13  O   LIG    1        4.502   0.503   2.724  0.00  0.00    -0.487 OA
ATOM     14  C   LIG    1        5.628   0.291   1.976  0.00  0.00    +0.128 A 
ATOM     15  C   LIG    1        5.590  -0.090   0.629  0.00  0.00    +0.019 A 
ATOM     16  C   LIG    1        6.789  -0.256  -0.073  0.00  0.00    +0.031 A 
ATOM     17  C   LIG    1        8.007  -0.037   0.573  0.00  0.00    +0.042 A 
ATOM     18  C   LIG    1        8.042   0.353   1.911  0.00  0.00    +0.023 A 
ATOM     19 CL   LIG    1        9.479  -0.241  -0.294  0.00  0.00    -0.084 Cl
ATOM     20  C   LIG    1        6.848   0.522   2.612  0.00  0.00    +0.048 A 
ATOM     21  C   LIG    1        4.304  -0.277  -0.032  0.00  0.00    +0.023 C 
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  22
ATOM     22  C   LIG    1       -2.982  -1.488  -2.073  0.00  0.00    +0.092 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.400  -1.601  -0.610  0.00  0.00    +0.069 A 
ATOM     24  C   LIG    1       -4.003  -0.419   0.085  0.00  0.00    -0.016 A 
ATOM     25  C   LIG    1       -4.261   0.866  -0.651  0.00  0.00    +0.037 C 
ATOM     26  C   LIG    1       -5.196   1.817   0.102  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -4.820   1.897   1.577  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -4.891   0.519   2.237  0.00  0.00    +0.041 C 
ATOM     29  C   LIG    1       -4.309  -0.575   1.385  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1       -4.075  -1.879   2.055  0.00  0.00    +0.268 A 
ATOM     31  O   LIG    1       -4.353  -2.057   3.236  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -3.550  -2.869   1.270  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1       -3.366  -3.763   1.711  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1       -3.203  -2.752  -0.039  0.00  0.00    -0.175 NA
ENDBRANCH  22  23
ENDBRANCH   3  22
TORSDOF 4