REMARK  Name = BDB019735
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.715   2.389   2.024  0.00  0.00    +0.125 A 
ATOM      2  C   LIG    1       -1.946   1.060   1.617  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -0.874   0.146   1.656  0.00  0.00    +0.021 A 
ATOM      4  C   LIG    1        0.420   0.557   1.989  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        0.634   1.878   2.382  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1       -0.429   2.787   2.409  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        1.582  -0.376   1.926  0.00  0.00    +0.244 C 
ATOM      8  N   LIG    1        1.446  -1.469   1.095  0.00  0.00    -0.307 N 
ATOM      9  H   LIG    1        0.667  -1.510   0.449  0.00  0.00    +0.149 HD
ATOM     10  O   LIG    1        2.602  -0.132   2.562  0.00  0.00    -0.270 OA
BRANCH   8  11
ATOM     11  C   LIG    1        2.548  -2.363   0.831  0.00  0.00    +0.140 C 
BRANCH  11  12
ATOM     12  C   LIG    1        3.168  -2.048  -0.507  0.00  0.00    -0.029 A 
ATOM     13  C   LIG    1        4.115  -1.018  -0.621  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1        4.670  -0.693  -1.863  0.00  0.00    +0.060 A 
ATOM     15 CL   LIG    1        5.828   0.587  -1.918  0.00  0.00    -0.082 Cl
ATOM     16  C   LIG    1        4.274  -1.396  -3.006  0.00  0.00    +0.059 A 
ATOM     17 CL   LIG    1        4.911  -1.051  -4.575  0.00  0.00    -0.082 Cl
ATOM     18  C   LIG    1        3.325  -2.417  -2.901  0.00  0.00    +0.022 A 
ATOM     19  C   LIG    1        2.771  -2.739  -1.660  0.00  0.00    +0.007 A 
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   4   7
BRANCH   1  21
ATOM     20  C   LIG    1       -2.615   4.572   2.385  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1       -2.812   3.212   2.015  0.00  0.00    -0.495 OA
ENDBRANCH   1  21
BRANCH   2  22
ATOM     22  C   LIG    1       -3.336   0.639   1.168  0.00  0.00    +0.143 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.368  -0.620   0.428  0.00  0.00    -0.313 N 
ATOM     24  H   LIG    1       -3.219  -1.419   1.034  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -2.741  -0.792  -0.756  0.00  0.00    +0.176 C 
ATOM     26  N   LIG    1       -2.845   0.191  -1.682  0.00  0.00    -0.316 N 
ATOM     27  H   LIG    1       -3.760   0.622  -1.724  0.00  0.00    +0.149 HD
ATOM     28  C   LIG    1       -2.347  -0.345  -2.929  0.00  0.00    +0.127 C 
ATOM     29  C   LIG    1       -1.556  -1.562  -2.437  0.00  0.00    +0.163 C 
ATOM     30  N   LIG    1       -2.045  -1.853  -1.057  0.00  0.00    -0.255 NA
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH   2  22
TORSDOF 7