REMARK  Name = BDB003392
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.025  -0.611   0.008  0.00  0.00    +0.113 C 
ATOM      2  C   LIG    1       -0.717   0.410  -0.842  0.00  0.00    +0.210 C 
ATOM      3  O   LIG    1       -0.130   1.036  -1.719  0.00  0.00    -0.285 OA
ATOM      4  C   LIG    1       -2.160   0.625  -0.639  0.00  0.00    +0.034 A 
ATOM      5  C   LIG    1       -2.863  -0.125   0.294  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -4.238   0.086   0.472  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -4.902   1.048  -0.290  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -4.198   1.801  -1.228  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -2.175  -1.134   1.111  0.00  0.00    +0.209 C 
ATOM     10  O   LIG    1       -2.778  -1.760   1.979  0.00  0.00    -0.285 OA
ATOM     11  C   LIG    1       -2.829   1.591  -1.404  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -0.704  -1.360   0.902  0.00  0.00    +0.098 C 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1        0.945  -2.932  -1.347  0.00  0.00    +0.110 C 
ATOM     14  C   LIG    1        1.880  -2.020  -0.576  0.00  0.00    +0.221 C 
ATOM     15  N   LIG    1        1.360  -0.767  -0.181  0.00  0.00    -0.235 N 
ATOM     16  O   LIG    1        3.026  -2.413  -0.342  0.00  0.00    -0.275 OA
BRANCH  15  17
ATOM     17  C   LIG    1        2.264   0.328   0.119  0.00  0.00    +0.041 A 
ATOM     18  C   LIG    1        3.571   0.372  -0.390  0.00  0.00    +0.024 A 
ATOM     19  C   LIG    1        4.433   1.435  -0.097  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        4.005   2.482   0.712  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        2.713   2.467   1.224  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        1.852   1.403   0.930  0.00  0.00    +0.024 A 
ENDBRANCH  15  17
ENDBRANCH   1  15
BRANCH  12  23
ATOM     23  N   LIG    1       -0.135  -2.323   1.734  0.00  0.00    -0.353 N 
ATOM     24  H   LIG    1       -0.739  -2.524   2.537  0.00  0.00    +0.142 HD
ATOM     25  H   LIG    1        0.828  -2.122   2.001  0.00  0.00    +0.142 HD
ENDBRANCH  12  23
TORSDOF 3