REMARK  Name = BDB060515
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.209  -0.108   0.945  0.00  0.00    +0.097 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.798   1.181   0.352  0.00  0.00    -0.034 A 
ATOM      3  C   LIG    1       -1.230   1.830  -0.759  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -1.809   2.989  -1.282  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1       -2.966   3.507  -0.705  0.00  0.00    +0.018 A 
ATOM      6 BR   LIG    1       -3.750   5.073  -1.416  0.00  0.00    -0.050 Br
ATOM      7  C   LIG    1       -3.552   2.876   0.389  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1       -2.972   1.718   0.913  0.00  0.00    +0.006 A 
ENDBRANCH   1   2
BRANCH   1  12
ATOM      9  C   LIG    1        3.119  -0.235   0.659  0.00  0.00    +0.132 A 
ATOM     10  C   LIG    1        2.373  -1.146  -0.084  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1        0.979  -1.124  -0.000  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        0.322  -0.205   0.837  0.00  0.00    -0.034 A 
ATOM     13  C   LIG    1        1.109   0.687   1.597  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        2.502   0.670   1.514  0.00  0.00    +0.046 A 
BRANCH   9  15
ATOM     15  O   LIG    1        4.514  -0.266   0.622  0.00  0.00    -0.426 OA
BRANCH  15  17
ATOM     16  C   LIG    1        6.551   0.157  -0.467  0.00  0.00    +0.136 C 
ATOM     17  C   LIG    1        5.056   0.251  -0.549  0.00  0.00    +0.309 C 
ATOM     18  O   LIG    1        4.449   0.715  -1.505  0.00  0.00    -0.251 OA
ENDBRANCH  15  17
ENDBRANCH   9  15
ENDBRANCH   1  12
BRANCH   1  19
ATOM     19  C   LIG    1       -1.981  -1.363   0.524  0.00  0.00    +0.053 A 
ATOM     20  N   LIG    1       -2.264  -2.264   1.504  0.00  0.00    -0.259 NA
ATOM     21  C   LIG    1       -2.936  -3.384   1.158  0.00  0.00    +0.111 A 
ATOM     22  C   LIG    1       -3.351  -3.666  -0.131  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1       -3.060  -2.744  -1.127  0.00  0.00    +0.003 A 
ATOM     24  C   LIG    1       -2.367  -1.581  -0.802  0.00  0.00    +0.024 A 
ENDBRANCH   1  19
TORSDOF 5