REMARK  Name = BDB014366
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.038  -0.329  -1.792  0.00  0.00    -0.297 N 
ATOM      2  C   LIG    1        0.144  -1.384  -1.271  0.00  0.00    +0.127 C 
ATOM      3  C   LIG    1       -1.059  -1.605  -2.216  0.00  0.00    +0.127 C 
ATOM      4  N   LIG    1       -1.772  -0.338  -2.515  0.00  0.00    -0.298 N 
ATOM      5  C   LIG    1       -0.843   0.669  -3.082  0.00  0.00    +0.127 C 
ATOM      6  C   LIG    1        0.359   0.931  -2.144  0.00  0.00    +0.127 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -2.670   0.069  -1.580  0.00  0.00    +0.197 A 
ATOM      8  N   LIG    1       -3.520   1.115  -1.834  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -3.562   1.624  -2.702  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -4.326   1.304  -0.742  0.00  0.00    +0.068 A 
ATOM     11  C   LIG    1       -3.933   0.309   0.150  0.00  0.00    +0.103 A 
ATOM     12  C   LIG    1       -4.581   0.219   1.398  0.00  0.00    +0.064 A 
ATOM     13  C   LIG    1       -5.603   1.141   1.691  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -5.973   2.124   0.769  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1       -5.341   2.226  -0.474  0.00  0.00    +0.028 A 
ATOM     16  N   LIG    1       -2.917  -0.452  -0.401  0.00  0.00    -0.214 NA
BRANCH  12  17
ATOM     17  C   LIG    1       -4.220  -0.808   2.403  0.00  0.00    +0.244 C 
ATOM     18  O   LIG    1       -4.788  -0.874   3.487  0.00  0.00    -0.270 OA
ATOM     19  N   LIG    1       -3.224  -1.683   2.077  0.00  0.00    -0.325 N 
ATOM     20  H   LIG    1       -2.952  -2.389   2.743  0.00  0.00    +0.145 HD
ATOM     21  H   LIG    1       -2.750  -1.625   1.178  0.00  0.00    +0.145 HD
ENDBRANCH  12  17
ENDBRANCH   4   7
BRANCH   1  25
ATOM     22  C   LIG    1        4.532   0.182   0.435  0.00  0.00    +0.064 A 
ATOM     23  C   LIG    1        3.769  -0.967   0.449  0.00  0.00    +0.138 A 
ATOM     24  N   LIG    1        2.634  -1.160  -0.264  0.00  0.00    -0.221 NA
ATOM     25  C   LIG    1        2.188  -0.145  -1.020  0.00  0.00    +0.218 A 
ATOM     26  N   LIG    1        2.830   1.032  -1.081  0.00  0.00    -0.221 NA
ATOM     27  C   LIG    1        3.959   1.167  -0.347  0.00  0.00    +0.138 A 
BRANCH  22  28
ATOM     28  N   LIG    1        5.662   0.435   1.203  0.00  0.00    -0.342 N 
ATOM     29  H   LIG    1        6.264   1.149   0.798  0.00  0.00    +0.146 HD
BRANCH  28  31
ATOM     30  C   LIG    1        5.902  -0.884   3.252  0.00  0.00    +0.024 C 
ATOM     31  C   LIG    1        6.405  -0.647   1.838  0.00  0.00    +0.098 C 
ENDBRANCH  28  31
ENDBRANCH  22  28
ENDBRANCH   1  25
TORSDOF 5