REMARK  Name = BDB065124
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.817  -0.644   0.364  0.00  0.00    +0.064 C 
ATOM      2  C   LIG    1        0.937   0.458   1.460  0.00  0.00    +0.127 C 
ATOM      3  C   LIG    1        0.385   1.794   0.985  0.00  0.00    +0.036 C 
ATOM      4  C   LIG    1       -1.121   1.746   0.678  0.00  0.00    -0.005 C 
ATOM      5  C   LIG    1       -1.487   3.142   0.134  0.00  0.00    +0.008 C 
ATOM      6  C   LIG    1       -1.603   0.524  -0.201  0.00  0.00    -0.026 C 
ATOM      7  C   LIG    1       -1.626   0.879  -1.708  0.00  0.00    +0.012 C 
ATOM      8  C   LIG    1        1.417  -2.056   0.871  0.00  0.00    +0.091 C 
ATOM      9  C   LIG    1        1.045  -3.184  -0.124  0.00  0.00    +0.037 C 
ATOM     10  C   LIG    1       -0.443  -3.284  -0.400  0.00  0.00    +0.003 C 
ATOM     11  C   LIG    1       -1.015  -1.961  -0.893  0.00  0.00    +0.005 C 
ATOM     12  C   LIG    1       -0.740  -0.804   0.098  0.00  0.00    +0.010 C 
ENDROOT
BRANCH   2  13
ATOM     13  O   LIG    1        2.266   0.630   1.927  0.00  0.00    -0.391 OA
ATOM     14  H   LIG    1        2.310   1.427   2.481  0.00  0.00    +0.210 HD
ENDBRANCH   2  13
BRANCH   8  15
ATOM     15  C   LIG    1        0.977  -2.396   2.326  0.00  0.00    +0.144 C 
ATOM     16 CL   LIG    1        1.634  -3.961   2.913  0.00  0.00    -0.122 Cl
ENDBRANCH   8  15
BRANCH   8  17
ATOM     17  O   LIG    1        2.856  -2.024   0.871  0.00  0.00    -0.387 OA
ATOM     18  H   LIG    1        3.174  -2.818   1.337  0.00  0.00    +0.210 HD
ENDBRANCH   8  17
BRANCH   1  19
ATOM     19  C   LIG    1        1.564  -0.210  -0.946  0.00  0.00    +0.245 C 
BRANCH  19  20
ATOM     20  O   LIG    1        2.933   0.138  -0.717  0.00  0.00    -0.461 OA
BRANCH  20  21
ATOM     21  C   LIG    1        3.663   0.402  -1.825  0.00  0.00    +0.335 C 
ATOM     22  O   LIG    1        3.226   0.423  -2.968  0.00  0.00    -0.245 OA
BRANCH  21  25
ATOM     23  C   LIG    1        6.949   0.760   0.271  0.00  0.00    +0.036 C 
ATOM     24  C   LIG    1        5.562   0.528  -0.235  0.00  0.00    -0.020 C 
ATOM     25  C   LIG    1        5.093   0.704  -1.489  0.00  0.00    +0.029 C 
ATOM     26  C   LIG    1        5.890   1.189  -2.664  0.00  0.00    +0.051 C 
ENDBRANCH  21  25
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH   1  19
BRANCH   6  27
ATOM     27  C   LIG    1       -3.097   0.144   0.201  0.00  0.00    +0.011 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -4.172   1.240   0.187  0.00  0.00    +0.035 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -5.535   0.694   0.475  0.00  0.00    -0.026 C 
ATOM     30  C   LIG    1       -6.282  -0.137  -0.496  0.00  0.00    +0.264 C 
ATOM     31  O   LIG    1       -7.523  -0.408   0.154  0.00  0.00    -0.457 OA
ATOM     32  C   LIG    1       -7.530   0.190   1.375  0.00  0.00    +0.332 C 
ATOM     33  O   LIG    1       -8.436   0.152   2.186  0.00  0.00    -0.246 OA
ATOM     34  C   LIG    1       -6.265   0.895   1.571  0.00  0.00    +0.094 C 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH   6  27
TORSDOF 10