REMARK  Name = BDB018479
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.572  -2.105  -0.051  0.00  0.00    -0.001 A 
ATOM      2  C   LIG    1        0.158  -2.143   0.356  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1       -0.444  -3.346   0.437  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        0.215  -4.532   0.165  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1       -0.518  -5.782   0.302  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        1.553  -4.569  -0.204  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1        2.195  -5.587  -0.443  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        2.226  -3.251  -0.314  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1        3.735   1.451  -0.576  0.00  0.00    +0.129 A 
ATOM     10  N   LIG    1        4.047   0.680   0.484  0.00  0.00    -0.240 NA
ATOM     11  C   LIG    1        3.341  -0.461   0.627  0.00  0.00    +0.122 A 
ATOM     12  C   LIG    1        2.342  -0.864  -0.237  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1        2.108   0.002  -1.287  0.00  0.00    +0.122 A 
ATOM     14  N   LIG    1        2.781   1.155  -1.481  0.00  0.00    -0.240 NA
BRANCH   9  16
ATOM     15  C   LIG    1        3.764   3.881  -0.015  0.00  0.00    +0.012 C 
ATOM     16  C   LIG    1        4.475   2.749  -0.738  0.00  0.00    +0.073 C 
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  17
ATOM     17  C   LIG    1       -0.565  -0.947   0.665  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1       -1.717  -0.508   0.052  0.00  0.00    +0.123 A 
ATOM     19  N   LIG    1       -2.074   0.686   0.655  0.00  0.00    -0.238 N 
ATOM     20  N   LIG    1       -1.205   0.997   1.639  0.00  0.00    -0.174 NA
ATOM     21  C   LIG    1       -0.295   0.026   1.637  0.00  0.00    +0.143 A 
BRANCH  19  22
ATOM     22  C   LIG    1       -3.172   1.544   0.331  0.00  0.00    +0.084 A 
ATOM     23  C   LIG    1       -3.532   2.655   1.134  0.00  0.00    +0.095 A 
ATOM     24  C   LIG    1       -4.611   3.465   0.722  0.00  0.00    +0.060 A 
ATOM     25 CL   LIG    1       -5.137   4.848   1.627  0.00  0.00    -0.082 Cl
ATOM     26  C   LIG    1       -5.322   3.183  -0.449  0.00  0.00    +0.021 A 
ATOM     27  C   LIG    1       -4.973   2.089  -1.228  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -3.907   1.275  -0.844  0.00  0.00    +0.029 A 
BRANCH  23  29
ATOM     29  C   LIG    1       -2.888   2.987   2.380  0.00  0.00    +0.103 C 
ATOM     30  N   LIG    1       -2.438   3.301   3.404  0.00  0.00    -0.191 NA
ENDBRANCH  23  29
ENDBRANCH  19  22
ENDBRANCH   2  17
TORSDOF 5