REMARK  Name = BDB015232
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.714  -1.196  -1.761  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1        2.807  -0.779  -0.779  0.00  0.00    +0.058 A 
ATOM      3  C   LIG    1        1.585  -1.440  -0.616  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        1.272  -2.521  -1.440  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.166  -2.930  -2.433  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        3.382  -2.267  -2.598  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        5.488  -0.476  -3.100  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        5.022  -0.512  -1.967  0.00  0.00    +0.249 C 
ATOM      9  N   LIG    1        5.603  -0.008  -0.828  0.00  0.00    -0.266 N 
ATOM     10  H   LIG    1        5.191  -0.194   0.076  0.00  0.00    +0.157 HD
BRANCH   9  11
ATOM     11  C   LIG    1        6.801   0.696  -0.708  0.00  0.00    +0.125 A 
ATOM     12  N   LIG    1        7.121   0.987   0.572  0.00  0.00    -0.240 NA
ATOM     13  C   LIG    1        8.265   1.672   0.789  0.00  0.00    +0.113 A 
ATOM     14  C   LIG    1        9.116   2.089  -0.218  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        8.770   1.786  -1.527  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1        7.595   1.079  -1.780  0.00  0.00    +0.044 A 
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  O   LIG    1        0.796  -0.929   0.377  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -0.499  -1.518   0.555  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.223  -0.771   1.686  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -0.628  -1.138   2.943  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -0.952  -0.493   3.596  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.731  -1.117   1.725  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.603   0.023   1.377  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -5.007  -0.301   1.712  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -6.004   0.745   1.259  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -5.677   1.665   0.249  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -6.628   2.603  -0.174  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -7.906   2.612   0.385  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -8.240   1.689   1.373  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -4.286   1.683  -0.328  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -7.295   0.758   1.807  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -3.513   0.387  -0.047  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 8