REMARK  Name = BDB014699
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -6.140  -2.171   0.967  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -4.637  -2.171   1.074  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -3.966  -1.026   0.664  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1       -2.505  -1.034   0.874  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -1.851   0.052   0.098  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -0.478   0.356  -0.113  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1       -0.357   1.452  -0.871  0.00  0.00    -0.156 NA
ATOM      8  N   LIG    1       -1.613   1.829  -1.159  0.00  0.00    -0.269 N 
ATOM      9  C   LIG    1       -1.822   2.984  -1.997  0.00  0.00    +0.172 C 
ATOM     10  C   LIG    1       -2.546   1.032  -0.579  0.00  0.00    +0.047 A 
ATOM     11  C   LIG    1       -4.021   1.129  -0.649  0.00  0.00    +0.074 C 
ATOM     12  C   LIG    1       -4.624   0.289   0.498  0.00  0.00    +0.114 C 
ATOM     13  O   LIG    1       -4.047  -3.164   1.503  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   6  14
ATOM     14  N   LIG    1        0.513  -0.405   0.415  0.00  0.00    -0.298 N 
ATOM     15  H   LIG    1        0.237  -1.231   0.931  0.00  0.00    +0.154 HD
BRANCH  14  16
ATOM     16  C   LIG    1        1.920  -0.285   0.360  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        2.704  -1.271   0.980  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        4.104  -1.212   0.963  0.00  0.00    +0.013 A 
ATOM     19  C   LIG    1        4.770  -0.160   0.324  0.00  0.00    +0.019 A 
ATOM     20  C   LIG    1        3.992   0.825  -0.295  0.00  0.00    +0.013 A 
ATOM     21  C   LIG    1        2.591   0.761  -0.276  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        6.225  -0.101   0.308  0.00  0.00    +0.155 A 
ATOM     23  O   LIG    1        6.808   0.964  -0.333  0.00  0.00    -0.442 OA
ATOM     24  C   LIG    1        8.143   0.753  -0.186  0.00  0.00    +0.308 A 
ATOM     25  N   LIG    1        8.470  -0.330   0.481  0.00  0.00    -0.224 NA
ATOM     26  C   LIG    1        7.252  -0.881   0.799  0.00  0.00    +0.160 A 
ENDBRANCH  19  22
ENDBRANCH  14  16
ENDBRANCH   6  14
TORSDOF 3