REMARK  Name = BDB063824
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.076  -1.043  -1.307  0.00  0.00    +0.041 C 
ATOM      2  C   LIG    1        0.755  -0.832  -1.367  0.00  0.00    +0.130 C 
ATOM      3  C   LIG    1       -0.145  -1.716  -2.155  0.00  0.00    +0.269 C 
ATOM      4  O   LIG    1        0.134  -2.683  -2.836  0.00  0.00    -0.268 OA
ATOM      5  N   LIG    1       -1.365  -1.170  -1.922  0.00  0.00    -0.253 N 
ATOM      6  H   LIG    1       -2.211  -1.509  -2.339  0.00  0.00    +0.158 HD
ATOM      7  C   LIG    1       -1.217  -0.097  -1.113  0.00  0.00    +0.188 C 
ATOM      8  N   LIG    1        0.007   0.150  -0.754  0.00  0.00    -0.213 NA
ENDROOT
BRANCH   1  15
ATOM      9  C   LIG    1        6.861  -1.806   1.455  0.00  0.00    +0.150 C 
ATOM     10  N   LIG    1        6.298  -0.487   1.320  0.00  0.00    -0.333 N 
ATOM     11  C   LIG    1        5.130  -0.168   0.674  0.00  0.00    +0.069 A 
ATOM     12  C   LIG    1        5.030   1.212   0.825  0.00  0.00    +0.089 A 
ATOM     13  C   LIG    1        3.933   1.883   0.270  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        2.963   1.140  -0.420  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1        3.063  -0.252  -0.554  0.00  0.00    -0.021 A 
ATOM     16  N   LIG    1        6.096   1.710   1.534  0.00  0.00    -0.236 NA
ATOM     17  C   LIG    1        4.173  -0.928  -0.012  0.00  0.00    +0.036 A 
ATOM     18  C   LIG    1        6.839   0.664   1.817  0.00  0.00    +0.200 A 
ENDBRANCH   1  15
BRANCH   7  19
ATOM     19  N   LIG    1       -2.269   0.663  -0.714  0.00  0.00    -0.314 N 
ATOM     20  H   LIG    1       -1.981   1.347  -0.018  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -3.642   0.207  -0.580  0.00  0.00    +0.073 C 
ATOM     22  C   LIG    1       -4.578   1.427  -0.531  0.00  0.00    +0.022 C 
ATOM     23  C   LIG    1       -5.872   1.176   0.249  0.00  0.00    +0.002 C 
ATOM     24  C   LIG    1       -6.287  -0.288   0.207  0.00  0.00    +0.000 C 
ATOM     25  C   LIG    1       -5.220  -1.198   0.818  0.00  0.00    +0.002 C 
ATOM     26  C   LIG    1       -3.796  -0.657   0.673  0.00  0.00    +0.022 C 
ENDBRANCH  19  21
ENDBRANCH   7  19
TORSDOF 3