REMARK  Name = BDB060556
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.116  -0.157  -0.236  0.00  0.00    +0.035 A 
ATOM      2  C   LIG    1        2.263   0.778  -0.840  0.00  0.00    +0.047 A 
ATOM      3  C   LIG    1        0.896   0.514  -0.979  0.00  0.00    +0.085 A 
ATOM      4 CL   LIG    1       -0.080   1.689  -1.783  0.00  0.00    -0.080 Cl
ATOM      5  C   LIG    1        0.368  -0.685  -0.495  0.00  0.00    +0.147 A 
ATOM      6  C   LIG    1        1.216  -1.635   0.076  0.00  0.00    +0.049 A 
ATOM      7  C   LIG    1        2.582  -1.366   0.214  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   1  10
ATOM      8  C   LIG    1        6.831   0.143   0.358  0.00  0.00    +0.109 C 
ATOM      9  C   LIG    1        5.496  -0.554   0.440  0.00  0.00    +0.214 C 
ATOM     10  N   LIG    1        4.480   0.190  -0.134  0.00  0.00    -0.286 N 
ATOM     11  H   LIG    1        4.739   1.093  -0.511  0.00  0.00    +0.155 HD
ATOM     12  O   LIG    1        5.390  -1.643   0.993  0.00  0.00    -0.276 OA
ENDBRANCH   1  10
BRANCH   5  13
ATOM     13  O   LIG    1       -0.957  -1.024  -0.624  0.00  0.00    -0.454 OA
BRANCH  13  14
ATOM     14  C   LIG    1       -1.865  -0.368   0.193  0.00  0.00    +0.136 A 
ATOM     15  C   LIG    1       -3.150  -0.111  -0.344  0.00  0.00    +0.024 A 
ATOM     16  C   LIG    1       -4.112   0.531   0.472  0.00  0.00    -0.014 A 
ATOM     17  C   LIG    1       -5.391   0.803  -0.042  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1       -5.729   0.451  -1.349  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -4.792  -0.179  -2.160  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -3.780   0.886   1.789  0.00  0.00    +0.009 A 
ATOM     21  C   LIG    1       -2.516   0.610   2.308  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -3.517  -0.456  -1.663  0.00  0.00    +0.012 A 
ATOM     23  C   LIG    1       -1.561  -0.021   1.516  0.00  0.00    +0.047 A 
ENDBRANCH  13  14
ENDBRANCH   5  13
TORSDOF 3