REMARK  Name = BDB065140
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.785  -2.161  -0.222  0.00  0.00    +0.096 C 
ATOM      2  C   LIG    1       -0.718  -3.655   0.396  0.00  0.00    +0.095 C 
ATOM      3  C   LIG    1       -0.202  -3.635   1.876  0.00  0.00    +0.037 C 
ATOM      4  C   LIG    1       -0.452  -2.335   2.630  0.00  0.00    +0.003 C 
ATOM      5  C   LIG    1        0.115  -1.110   1.906  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1        0.420  -1.369   0.408  0.00  0.00    +0.015 C 
ATOM      7  C   LIG    1        1.139  -0.139  -0.346  0.00  0.00    -0.025 C 
ATOM      8  C   LIG    1        0.486   1.208   0.002  0.00  0.00    +0.012 C 
ATOM      9  C   LIG    1        1.133  -0.395  -1.897  0.00  0.00    -0.001 C 
ATOM     10  C   LIG    1        1.490   0.809  -2.788  0.00  0.00    +0.008 C 
ATOM     11  C   LIG    1       -0.222  -0.882  -2.408  0.00  0.00    +0.079 C 
ATOM     12  C   LIG    1       -0.662  -2.155  -1.744  0.00  0.00    +0.146 C 
ATOM     13  O   LIG    1       -1.014  -3.101  -2.449  0.00  0.00    -0.297 OA
ENDROOT
BRANCH   2  14
ATOM     14  C   LIG    1        0.167  -4.647  -0.426  0.00  0.00    +0.144 C 
ATOM     15 CL   LIG    1        0.348  -6.246   0.382  0.00  0.00    -0.122 Cl
ENDBRANCH   2  14
BRANCH   2  16
ATOM     16  O   LIG    1       -2.050  -4.203   0.441  0.00  0.00    -0.386 OA
ATOM     17  H   LIG    1       -1.976  -5.153   0.653  0.00  0.00    +0.210 HD
ENDBRANCH   2  16
BRANCH   1  18
ATOM     18  C   LIG    1       -2.220  -1.592   0.038  0.00  0.00    +0.250 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -2.338  -0.190  -0.233  0.00  0.00    -0.460 OA
BRANCH  19  20
ATOM     20  C   LIG    1       -3.443   0.400   0.303  0.00  0.00    +0.335 C 
ATOM     21  O   LIG    1       -4.257  -0.138   1.037  0.00  0.00    -0.245 OA
BRANCH  20  24
ATOM     22  C   LIG    1       -3.120   3.651  -1.821  0.00  0.00    +0.036 C 
ATOM     23  C   LIG    1       -3.095   2.260  -1.273  0.00  0.00    -0.020 C 
ATOM     24  C   LIG    1       -3.518   1.846  -0.062  0.00  0.00    +0.029 C 
ATOM     25  C   LIG    1       -4.119   2.705   1.010  0.00  0.00    +0.051 C 
ENDBRANCH  20  24
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
BRANCH   7  26
ATOM     26  C   LIG    1        2.634  -0.148   0.211  0.00  0.00    +0.011 C 
BRANCH  26  27
ATOM     27  C   LIG    1        3.720   0.846  -0.233  0.00  0.00    +0.035 C 
BRANCH  27  28
ATOM     28  C   LIG    1        3.549   2.268   0.184  0.00  0.00    -0.026 C 
ATOM     29  C   LIG    1        3.472   2.674   1.606  0.00  0.00    +0.264 C 
ATOM     30  O   LIG    1        3.348   4.095   1.561  0.00  0.00    -0.457 OA
ATOM     31  C   LIG    1        3.366   4.505   0.265  0.00  0.00    +0.332 C 
ATOM     32  O   LIG    1        3.276   5.655  -0.124  0.00  0.00    -0.246 OA
ATOM     33  C   LIG    1        3.508   3.340  -0.605  0.00  0.00    +0.094 C 
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH   7  26
TORSDOF 9