REMARK  Name = BDB014698
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.355  -2.978  -0.112  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -3.886  -2.694   0.067  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -3.481  -1.366   0.028  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1       -2.051  -1.126   0.302  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -1.654   0.246  -0.106  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -0.381   0.877  -0.154  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1       -0.505   2.143  -0.569  0.00  0.00    -0.156 NA
ATOM      8  N   LIG    1       -1.817   2.315  -0.804  0.00  0.00    -0.269 N 
ATOM      9  C   LIG    1       -2.278   3.590  -1.297  0.00  0.00    +0.172 C 
ATOM     10  C   LIG    1       -2.550   1.209  -0.517  0.00  0.00    +0.047 A 
ATOM     11  C   LIG    1       -4.012   1.012  -0.632  0.00  0.00    +0.074 C 
ATOM     12  C   LIG    1       -4.409  -0.225   0.203  0.00  0.00    +0.114 C 
ATOM     13  O   LIG    1       -3.092  -3.621   0.232  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   6  14
ATOM     14  N   LIG    1        0.757   0.221   0.189  0.00  0.00    -0.298 N 
ATOM     15  H   LIG    1        0.668  -0.756   0.438  0.00  0.00    +0.154 HD
BRANCH  14  16
ATOM     16  C   LIG    1        2.106   0.644   0.246  0.00  0.00    +0.033 A 
ATOM     17  C   LIG    1        3.093  -0.299   0.595  0.00  0.00    +0.035 A 
ATOM     18  C   LIG    1        4.457   0.038   0.674  0.00  0.00    +0.021 A 
ATOM     19  C   LIG    1        4.830   1.357   0.396  0.00  0.00    +0.012 A 
ATOM     20  C   LIG    1        3.871   2.306   0.048  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        2.523   1.950  -0.025  0.00  0.00    +0.023 A 
BRANCH  18  22
ATOM     22  C   LIG    1        5.448  -0.967   1.038  0.00  0.00    +0.155 A 
ATOM     23  O   LIG    1        6.758  -0.562   1.115  0.00  0.00    -0.442 OA
ATOM     24  C   LIG    1        7.436  -1.688   1.467  0.00  0.00    +0.308 A 
ATOM     25  N   LIG    1        6.696  -2.761   1.622  0.00  0.00    -0.224 NA
ATOM     26  C   LIG    1        5.428  -2.311   1.350  0.00  0.00    +0.160 A 
ENDBRANCH  18  22
ENDBRANCH  14  16
ENDBRANCH   6  14
TORSDOF 3