REMARK  Name = BDB017157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.555  -0.606  -0.088  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1       -4.061   0.725  -0.227  0.00  0.00    -0.012 A 
ATOM      3  C   LIG    1       -3.207   1.824   0.055  0.00  0.00    -0.017 A 
ATOM      4  C   LIG    1       -3.681   3.140  -0.072  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1       -4.991   3.397  -0.471  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -5.844   2.339  -0.745  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -1.886   1.603   0.468  0.00  0.00    +0.020 A 
ATOM      8  C   LIG    1       -1.394   0.306   0.601  0.00  0.00    +0.019 A 
ATOM      9  C   LIG    1       -5.386   1.024  -0.623  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1       -2.228  -0.786   0.343  0.00  0.00    +0.018 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -3.756  -3.167  -0.508  0.00  0.00    +0.043 C 
ATOM     12  C   LIG    1       -4.445  -1.810  -0.377  0.00  0.00    +0.142 C 
BRANCH  12  13
ATOM     13  O   LIG    1       -5.433  -1.940   0.647  0.00  0.00    -0.387 OA
ATOM     14  H   LIG    1       -5.158  -1.387   1.399  0.00  0.00    +0.210 HD
ENDBRANCH  12  13
ENDBRANCH   1  12
BRANCH   8  15
ATOM     15  C   LIG    1       -0.002   0.039   1.055  0.00  0.00    +0.167 C 
ATOM     16  O   LIG    1        0.156  -0.895   1.839  0.00  0.00    -0.292 OA
BRANCH  15  17
ATOM     17  C   LIG    1        1.135   0.963   0.596  0.00  0.00    +0.074 C 
ATOM     18  C   LIG    1        2.509   0.440   1.064  0.00  0.00    +0.095 C 
ATOM     19  N   LIG    1        2.992  -0.690   0.263  0.00  0.00    -0.301 NA
ATOM     20  C   LIG    1        3.082  -0.386  -1.161  0.00  0.00    +0.084 C 
ATOM     21  C   LIG    1        1.713   0.033  -1.694  0.00  0.00    +0.016 C 
ATOM     22  C   LIG    1        1.159   1.225  -0.918  0.00  0.00    +0.014 C 
BRANCH  19  23
ATOM     23  C   LIG    1        4.191  -1.327   0.808  0.00  0.00    +0.088 C 
BRANCH  23  24
ATOM     24  C   LIG    1        5.432  -0.484   0.762  0.00  0.00    +0.003 C 
ATOM     25  C   LIG    1        6.363  -0.516  -0.426  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1        6.784  -1.147   0.871  0.00  0.00    +0.005 C 
ENDBRANCH  23  24
ENDBRANCH  19  23
ENDBRANCH  15  17
ENDBRANCH   8  15
TORSDOF 6