REMARK  Name = BDB034431
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.141   0.912  -0.161  0.00  0.00    -0.343 N 
ATOM      2  H   LIG    1       -0.144  -0.022   0.242  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1       -5.004  -0.742  -0.431  0.00  0.00    -0.045 A 
ATOM      4  C   LIG    1       -4.720   0.011  -1.579  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1       -3.483   0.607  -1.794  0.00  0.00    +0.073 A 
ATOM      6  C   LIG    1       -2.458   0.439  -0.835  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1       -1.190   1.040  -1.097  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -1.070   1.835  -2.238  0.00  0.00    +0.043 A 
ATOM      9  C   LIG    1       -2.141   1.937  -3.104  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1       -2.754  -0.310   0.331  0.00  0.00    +0.012 A 
ATOM     11  N   LIG    1       -3.325   1.329  -2.913  0.00  0.00    -0.255 NA
ATOM     12  C   LIG    1       -4.007  -0.894   0.528  0.00  0.00    +0.004 A 
BRANCH   3  13
ATOM     13  C   LIG    1       -6.367  -1.361  -0.235  0.00  0.00    +0.038 C 
BRANCH  13  15
ATOM     14  C   LIG    1       -7.622   0.764   0.399  0.00  0.00    +0.007 C 
ATOM     15  C   LIG    1       -7.226  -0.651   0.830  0.00  0.00    -0.013 C 
ATOM     16  C   LIG    1       -8.484  -1.474   1.114  0.00  0.00    +0.007 C 
ENDBRANCH  13  15
ENDBRANCH   3  13
ENDBRANCH   1   7
BRANCH   1  17
ATOM     17  C   LIG    1        1.206   1.367  -0.497  0.00  0.00    +0.103 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.150   1.060   0.668  0.00  0.00    +0.034 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.568   1.542   0.355  0.00  0.00    +0.083 C 
BRANCH  19  20
ATOM     20  N   LIG    1        4.515   1.355   1.452  0.00  0.00    -0.312 NA
ATOM     21  H   LIG    1        4.152   1.794   2.297  0.00  0.00    +0.122 HD
BRANCH  20  22
ATOM     22  C   LIG    1        4.860  -0.035   1.759  0.00  0.00    +0.120 C 
BRANCH  22  23
ATOM     23  C   LIG    1        5.608  -0.743   0.664  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1        6.963  -0.543   0.452  0.00  0.00    +0.171 A 
ATOM     25  O   LIG    1        7.783   0.260   1.187  0.00  0.00    -0.452 OA
ATOM     26  C   LIG    1        9.034   0.089   0.495  0.00  0.00    +0.466 C 
ATOM     27  O   LIG    1        8.963  -0.848  -0.598  0.00  0.00    -0.453 OA
ATOM     28  C   LIG    1        7.644  -1.181  -0.562  0.00  0.00    +0.167 A 
ATOM     29  C   LIG    1        7.021  -2.057  -1.424  0.00  0.00    +0.049 A 
ATOM     30  C   LIG    1        5.657  -2.288  -1.239  0.00  0.00    +0.004 A 
ATOM     31  C   LIG    1        4.957  -1.637  -0.206  0.00  0.00    +0.009 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 9