REMARK  Name = BDB006156
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.045   0.006  -0.319  0.00  0.00    +0.146 C 
ATOM      2  N   LIG    1       -1.390  -0.362  -1.726  0.00  0.00    -0.254 N 
ATOM      3  C   LIG    1       -0.296  -0.258  -2.614  0.00  0.00    +0.272 C 
ATOM      4  O   LIG    1       -0.282  -0.373  -3.830  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1        0.835  -0.007  -1.747  0.00  0.00    +0.153 A 
ATOM      6  N   LIG    1        2.144   0.108  -1.924  0.00  0.00    -0.166 NA
ATOM      7  N   LIG    1        2.607   0.272  -0.653  0.00  0.00    -0.263 N 
ATOM      8  C   LIG    1        1.599   0.291   0.311  0.00  0.00    +0.048 A 
ATOM      9  C   LIG    1        0.438   0.137  -0.417  0.00  0.00    +0.031 A 
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1       -2.760   0.415   2.178  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -2.388   1.545   1.257  0.00  0.00    -0.044 A 
ATOM     12  C   LIG    1       -1.593   1.374   0.097  0.00  0.00    -0.019 A 
ATOM     13  C   LIG    1       -1.347   2.517  -0.706  0.00  0.00    +0.007 A 
ATOM     14  C   LIG    1       -1.857   3.774  -0.378  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -2.638   3.920   0.758  0.00  0.00    +0.041 A 
ATOM     16 CL   LIG    1       -3.278   5.463   1.168  0.00  0.00    -0.084 Cl
ATOM     17  C   LIG    1       -2.908   2.819   1.566  0.00  0.00    +0.023 A 
ENDBRANCH   1  12
BRANCH   2  18
ATOM     18  C   LIG    1       -2.737  -0.471  -2.153  0.00  0.00    +0.042 A 
ATOM     19  C   LIG    1       -3.650  -1.346  -1.529  0.00  0.00    -0.029 A 
ATOM     20  C   LIG    1       -3.247  -2.376  -0.510  0.00  0.00    +0.045 C 
ATOM     21  C   LIG    1       -5.000  -1.323  -1.926  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1       -5.430  -0.492  -2.960  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1       -4.510   0.317  -3.615  0.00  0.00    +0.043 A 
ATOM     24 CL   LIG    1       -5.033   1.332  -4.903  0.00  0.00    -0.083 Cl
ATOM     25  C   LIG    1       -3.172   0.325  -3.225  0.00  0.00    +0.043 A 
ENDBRANCH   2  18
BRANCH   8  26
ATOM     26  C   LIG    1        1.867   0.413   1.786  0.00  0.00    +0.032 C 
ATOM     27  C   LIG    1        1.397  -0.834   2.533  0.00  0.00    +0.014 C 
ATOM     28  C   LIG    1        1.251   1.678   2.377  0.00  0.00    +0.014 C 
ENDBRANCH   8  26
BRANCH   7  29
ATOM     29  C   LIG    1        4.051   0.412  -0.460  0.00  0.00    +0.179 C 
BRANCH  29  30
ATOM     30  C   LIG    1        4.690  -0.853   0.062  0.00  0.00    -0.026 A 
ATOM     31  C   LIG    1        4.550  -2.069  -0.627  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        5.155  -3.231  -0.147  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1        5.915  -3.192   1.019  0.00  0.00    +0.000 A 
ATOM     34  C   LIG    1        6.076  -1.990   1.704  0.00  0.00    +0.000 A 
ATOM     35  C   LIG    1        5.472  -0.826   1.227  0.00  0.00    +0.005 A 
ENDBRANCH  29  30
ENDBRANCH   7  29
TORSDOF 5