REMARK  Name = BDB027962
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.291   0.527  -0.155  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1        0.765   0.319   1.065  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.576   0.156   1.161  0.00  0.00    +0.116 A 
ATOM      4  C   LIG    1       -1.454   0.184   0.084  0.00  0.00    -0.026 A 
ATOM      5  C   LIG    1       -0.888   0.385  -1.174  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        0.491   0.555  -1.294  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -2.939  -0.015   0.290  0.00  0.00    +0.023 C 
ATOM      8  C   LIG    1       -3.774   1.145  -0.269  0.00  0.00    +0.023 C 
ATOM      9  C   LIG    1       -5.262   0.925   0.019  0.00  0.00    +0.081 C 
ATOM     10  N   LIG    1       -5.723  -0.457  -0.141  0.00  0.00    -0.316 NA
ATOM     11  H   LIG    1       -5.842  -0.883   0.779  0.00  0.00    +0.122 HD
ATOM     12  C   LIG    1       -4.802  -1.269  -0.930  0.00  0.00    +0.081 C 
ATOM     13  C   LIG    1       -3.425  -1.367  -0.271  0.00  0.00    +0.023 C 
ENDBRANCH   4   7
BRANCH   1  14
ATOM     14  N   LIG    1        2.680   0.683  -0.322  0.00  0.00    -0.318 N 
ATOM     15  H   LIG    1        2.820   1.548  -0.848  0.00  0.00    +0.148 HD
BRANCH  14  22
ATOM     16  O   LIG    1        6.880  -1.357  -0.182  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1        5.891  -0.778   0.260  0.00  0.00    +0.219 C 
ATOM     18  N   LIG    1        5.904   0.577   0.461  0.00  0.00    -0.255 N 
ATOM     19  H   LIG    1        6.756   1.044   0.185  0.00  0.00    +0.158 HD
ATOM     20  C   LIG    1        4.810   1.391   0.620  0.00  0.00    +0.239 C 
ATOM     21  O   LIG    1        4.902   2.602   0.412  0.00  0.00    -0.273 OA
ATOM     22  C   LIG    1        3.464   0.714   0.926  0.00  0.00    +0.159 C 
ATOM     23  C   LIG    1        3.712  -0.691   1.481  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1        4.595  -1.496   0.540  0.00  0.00    +0.098 C 
ENDBRANCH  14  22
ENDBRANCH   1  14
TORSDOF 3