REMARK  Name = BDB028171
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.369  -0.517   0.201  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1       -0.772   0.278   0.014  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -1.893  -0.238  -0.648  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -1.875  -1.555  -1.103  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -3.067  -2.099  -1.773  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.137  -1.248  -1.891  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -4.970  -1.607  -2.347  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -4.183   0.046  -1.473  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -3.092  -3.250  -2.196  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -0.745  -2.358  -0.915  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -3.130   0.546  -0.893  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1        0.374  -1.838  -0.264  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  19
ATOM     13  C   LIG    1        3.431  -0.468  -0.829  0.00  0.00    +0.066 C 
ATOM     14  C   LIG    1        2.824   0.028   0.434  0.00  0.00    +0.044 A 
ATOM     15  N   LIG    1        3.560   0.635   1.425  0.00  0.00    -0.271 N 
ATOM     16  C   LIG    1        4.987   0.861   1.445  0.00  0.00    +0.172 C 
ATOM     17  N   LIG    1        2.819   1.067   2.461  0.00  0.00    -0.179 NA
ATOM     18  C   LIG    1        1.579   0.693   2.141  0.00  0.00    +0.143 A 
ATOM     19  C   LIG    1        1.518   0.026   0.898  0.00  0.00    +0.022 A 
ENDBRANCH   1  19
BRANCH  11  20
ATOM     20  C   LIG    1       -3.206   2.005  -0.450  0.00  0.00    +0.136 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.438   2.056   0.995  0.00  0.00    -0.325 NA
ATOM     22  H   LIG    1       -4.319   1.575   1.194  0.00  0.00    +0.119 HD
ATOM     23  H   LIG    1       -3.594   3.026   1.269  0.00  0.00    +0.119 HD
ENDBRANCH  20  21
ENDBRANCH  11  20
TORSDOF 3