REMARK  Name = BDB059076
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.492  -1.954  -1.131  0.00  0.00    +0.044 A 
ATOM      2  N   LIG    1       -0.277  -1.717  -0.595  0.00  0.00    -0.232 NA
ATOM      3  C   LIG    1       -0.023  -0.432  -0.254  0.00  0.00    +0.165 A 
ATOM      4  C   LIG    1       -0.891   0.642  -0.429  0.00  0.00    +0.056 A 
ATOM      5  C   LIG    1       -0.176   1.770   0.051  0.00  0.00    +0.076 A 
ATOM      6  N   LIG    1        1.034   1.429   0.509  0.00  0.00    -0.169 NA
ATOM      7  C   LIG    1       -2.140   0.350  -1.003  0.00  0.00    +0.073 A 
ATOM      8  N   LIG    1        1.131   0.082   0.334  0.00  0.00    -0.214 N 
ATOM      9  C   LIG    1       -2.446  -0.970  -1.346  0.00  0.00    +0.039 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1        2.326  -0.592   0.740  0.00  0.00    +0.068 A 
ATOM     11  C   LIG    1        3.375   0.158   1.306  0.00  0.00    +0.029 A 
ATOM     12  C   LIG    1        4.558  -0.466   1.715  0.00  0.00    +0.022 A 
ATOM     13  C   LIG    1        4.703  -1.841   1.562  0.00  0.00    +0.041 A 
ATOM     14 CL   LIG    1        6.157  -2.611   2.064  0.00  0.00    -0.084 Cl
ATOM     15  C   LIG    1        3.674  -2.597   1.006  0.00  0.00    +0.022 A 
ATOM     16  C   LIG    1        2.488  -1.976   0.595  0.00  0.00    +0.029 A 
ENDBRANCH   8  10
BRANCH   5  17
ATOM     17  C   LIG    1       -0.604   3.216   0.105  0.00  0.00    +0.034 C 
ATOM     18  C   LIG    1        0.509   4.175  -0.336  0.00  0.00    +0.014 C 
ATOM     19  C   LIG    1       -1.103   3.592   1.501  0.00  0.00    +0.014 C 
ENDBRANCH   5  17
BRANCH   1  21
ATOM     20  C   LIG    1       -2.459  -4.106  -0.290  0.00  0.00    +0.010 C 
ATOM     21  C   LIG    1       -1.806  -3.392  -1.463  0.00  0.00    +0.052 C 
ENDBRANCH   1  21
BRANCH   7  22
ATOM     22  C   LIG    1       -3.154   1.390  -1.201  0.00  0.00    +0.338 C 
ATOM     23  O   LIG    1       -3.598   2.076  -0.300  0.00  0.00    -0.245 OA
BRANCH  22  24
ATOM     24  O   LIG    1       -3.532   1.489  -2.492  0.00  0.00    -0.477 OA
ATOM     25  H   LIG    1       -3.012   0.951  -3.119  0.00  0.00    +0.295 HD
ENDBRANCH  22  24
ENDBRANCH   7  22
TORSDOF 5