REMARK  Name = BDB061342
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.527  -1.966  -1.070  0.00  0.00    -0.490 OA
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1        4.140  -1.613   2.187  0.00  0.00    +0.088 A 
ATOM      3  C   LIG    1        4.437  -2.427   1.093  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1        3.548  -2.516   0.020  0.00  0.00    +0.085 A 
ATOM      5 CL   LIG    1        3.996  -3.524  -1.314  0.00  0.00    -0.080 Cl
ATOM      6  C   LIG    1        2.333  -1.809   0.026  0.00  0.00    +0.139 A 
ATOM      7  C   LIG    1        2.021  -1.028   1.141  0.00  0.00    +0.049 A 
ATOM      8  C   LIG    1        2.915  -0.938   2.214  0.00  0.00    +0.033 A 
BRANCH   2  10
ATOM      9  N   LIG    1        5.923  -0.662   3.318  0.00  0.00    -0.149 NA
ATOM     10  N   LIG    1        5.019  -1.538   3.283  0.00  0.00    -0.149 NA
BRANCH   9  15
ATOM     11  C   LIG    1        6.557   3.133  -0.920  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1        6.413   2.150   0.204  0.00  0.00    -0.050 A 
ATOM     13  C   LIG    1        7.074   0.918   0.157  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        6.914  -0.010   1.189  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1        6.066   0.264   2.267  0.00  0.00    +0.086 A 
ATOM     16  C   LIG    1        5.418   1.502   2.320  0.00  0.00    +0.030 A 
ATOM     17  C   LIG    1        5.577   2.434   1.291  0.00  0.00    +0.005 A 
ENDBRANCH   9  15
ENDBRANCH   2  10
ENDBRANCH   1   6
BRANCH   1  18
ATOM     18  C   LIG    1        0.379  -1.130  -1.221  0.00  0.00    +0.234 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -0.855  -1.800  -0.616  0.00  0.00    +0.076 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.086  -0.942  -0.746  0.00  0.00    -0.044 A 
ATOM     21  C   LIG    1       -2.468  -0.083   0.294  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1       -3.595   0.730   0.162  0.00  0.00    +0.046 A 
ATOM     23  C   LIG    1       -4.361   0.670  -0.999  0.00  0.00    +0.122 A 
ATOM     24  C   LIG    1       -3.966  -0.144  -2.058  0.00  0.00    +0.046 A 
ATOM     25  C   LIG    1       -2.840  -0.958  -1.928  0.00  0.00    +0.007 A 
BRANCH  23  26
ATOM     26  O   LIG    1       -5.431   1.500  -1.163  0.00  0.00    -0.475 OA
BRANCH  26  27
ATOM     27  C   LIG    1       -6.702   1.010  -0.678  0.00  0.00    +0.200 C 
ATOM     28  C   LIG    1       -6.784   1.102   0.852  0.00  0.00    +0.067 C 
ATOM     29  C   LIG    1       -7.073  -0.401  -1.155  0.00  0.00    +0.067 C 
BRANCH  27  30
ATOM     30  C   LIG    1       -7.733   1.980  -1.278  0.00  0.00    +0.348 C 
ATOM     31  O   LIG    1       -8.574   2.627  -0.672  0.00  0.00    -0.247 OA
BRANCH  30  32
ATOM     32  O   LIG    1       -7.670   2.075  -2.626  0.00  0.00    -0.478 OA
ATOM     33  H   LIG    1       -8.349   2.745  -2.848  0.00  0.00    +0.295 HD
ENDBRANCH  30  32
ENDBRANCH  27  30
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 10