REMARK  Name = BDB007060
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.149   1.029  -0.436  0.00  0.00    +0.136 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.082   0.144  -0.638  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        1.167   0.138   0.252  0.00  0.00    +0.148 A 
ATOM      4  C   LIG    1        2.302  -0.648   0.063  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1        2.352  -1.478  -1.071  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        3.496  -2.263  -1.252  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1        4.531  -2.200  -0.325  0.00  0.00    +0.023 A 
ATOM      8  C   LIG    1        4.399  -1.352   0.768  0.00  0.00    +0.039 A 
ATOM      9  C   LIG    1        5.497  -1.261   1.785  0.00  0.00    +0.065 C 
ATOM     10  C   LIG    1        1.275  -1.503  -1.973  0.00  0.00    +0.010 A 
ATOM     11  N   LIG    1        3.302  -0.582   0.969  0.00  0.00    -0.248 NA
ATOM     12  C   LIG    1        0.153  -0.700  -1.756  0.00  0.00    +0.010 A 
BRANCH   3  13
ATOM     13  O   LIG    1        1.124   0.932   1.381  0.00  0.00    -0.504 OA
ATOM     14  H   LIG    1        1.995   0.771   1.808  0.00  0.00    +0.292 HD
ENDBRANCH   3  13
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.875   2.535  -0.622  0.00  0.00    -0.021 A 
ATOM     16  C   LIG    1        0.121   3.005  -1.500  0.00  0.00    +0.027 A 
ATOM     17  C   LIG    1        0.334   4.376  -1.691  0.00  0.00    +0.060 A 
ATOM     18 CL   LIG    1        1.593   4.848  -2.778  0.00  0.00    -0.082 Cl
ATOM     19  C   LIG    1       -0.463   5.307  -1.020  0.00  0.00    +0.059 A 
ATOM     20 CL   LIG    1       -0.259   7.013  -1.209  0.00  0.00    -0.082 Cl
ATOM     21  C   LIG    1       -1.475   4.863  -0.170  0.00  0.00    +0.022 A 
ATOM     22  C   LIG    1       -1.683   3.493   0.019  0.00  0.00    +0.007 A 
ENDBRANCH   1  15
BRANCH   1  23
ATOM     23  N   LIG    1       -1.718   0.795   0.896  0.00  0.00    -0.318 N 
ATOM     24  H   LIG    1       -0.964   0.838   1.582  0.00  0.00    +0.148 HD
BRANCH  23  28
ATOM     25  C   LIG    1       -3.936  -3.037  -1.022  0.00  0.00    +0.065 C 
ATOM     26  C   LIG    1       -3.560  -2.240   0.190  0.00  0.00    +0.040 A 
ATOM     27  N   LIG    1       -2.820  -1.123  -0.010  0.00  0.00    -0.237 NA
ATOM     28  C   LIG    1       -2.449  -0.390   1.060  0.00  0.00    +0.120 A 
ATOM     29  C   LIG    1       -2.848  -0.737   2.348  0.00  0.00    +0.043 A 
ATOM     30  C   LIG    1       -3.611  -1.884   2.547  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -3.971  -2.653   1.451  0.00  0.00    +0.023 A 
ENDBRANCH  23  28
ENDBRANCH   1  23
TORSDOF 5