REMARK  Name = BDB036934
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.258   0.464   0.822  0.00  0.00    -0.288 NA
ATOM      2  C   LIG    1       -1.713  -0.412   1.875  0.00  0.00    +0.104 C 
ATOM      3  C   LIG    1       -0.306  -0.986   1.605  0.00  0.00    +0.126 C 
ATOM      4  N   LIG    1        0.609   0.002   1.053  0.00  0.00    -0.265 N 
ATOM      5  C   LIG    1        1.948  -0.032   1.381  0.00  0.00    +0.403 C 
ATOM      6  O   LIG    1        2.443  -0.865   2.131  0.00  0.00    -0.226 OA
ATOM      7  C   LIG    1        0.061   0.948   0.082  0.00  0.00    +0.126 C 
ATOM      8  C   LIG    1       -1.378   0.600  -0.343  0.00  0.00    +0.104 C 
ENDROOT
BRANCH   1  15
ATOM      9  O   LIG    1       -7.149   0.079  -1.727  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1       -6.108   0.116  -1.079  0.00  0.00    +0.219 C 
ATOM     11  N   LIG    1       -5.460   1.301  -0.843  0.00  0.00    -0.255 N 
ATOM     12  H   LIG    1       -5.875   2.125  -1.257  0.00  0.00    +0.158 HD
ATOM     13  C   LIG    1       -4.310   1.517  -0.115  0.00  0.00    +0.236 C 
ATOM     14  O   LIG    1       -3.875   2.661   0.001  0.00  0.00    -0.274 OA
ATOM     15  C   LIG    1       -3.692   0.267   0.552  0.00  0.00    +0.144 C 
ATOM     16  C   LIG    1       -4.001  -0.973  -0.293  0.00  0.00    +0.037 C 
ATOM     17  C   LIG    1       -5.507  -1.117  -0.450  0.00  0.00    +0.098 C 
ENDBRANCH   1  15
BRANCH   5  18
ATOM     18  O   LIG    1        2.645   0.966   0.777  0.00  0.00    -0.445 OA
BRANCH  18  19
ATOM     19  C   LIG    1        4.053   0.989   1.030  0.00  0.00    +0.269 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.779   0.343  -0.122  0.00  0.00    -0.010 A 
ATOM     21  C   LIG    1        5.065   1.073  -1.284  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1        5.721   0.466  -2.356  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        6.088  -0.876  -2.281  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        5.796  -1.615  -1.136  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.141  -1.010  -0.062  0.00  0.00    +0.007 A 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   5  18
TORSDOF 4