REMARK  Name = BDB051632
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.325   0.383  -0.821  0.00  0.00    +0.065 A 
ATOM      2  C   LIG    1       -1.668   0.550  -2.047  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1       -0.274   0.683  -2.080  0.00  0.00    +0.015 A 
ATOM      4  C   LIG    1        0.475   0.643  -0.898  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -0.181   0.493   0.328  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1       -1.573   0.358   0.365  0.00  0.00    +0.028 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -6.777  -0.260   1.049  0.00  0.00    +0.064 A 
ATOM      8  C   LIG    1       -5.666  -0.059   0.201  0.00  0.00    +0.105 A 
ATOM      9  C   LIG    1       -5.869   0.058  -1.221  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1       -4.643   0.245  -1.794  0.00  0.00    +0.123 A 
ATOM     11  N   LIG    1       -3.742   0.241  -0.751  0.00  0.00    -0.239 N 
ATOM     12  C   LIG    1       -7.071  -0.003  -1.917  0.00  0.00    +0.011 A 
ATOM     13  C   LIG    1       -8.158  -0.206  -1.044  0.00  0.00    +0.001 A 
ATOM     14  N   LIG    1       -4.354   0.086   0.451  0.00  0.00    -0.166 NA
ATOM     15  C   LIG    1       -8.024  -0.331   0.373  0.00  0.00    +0.015 A 
BRANCH   7  19
ATOM     16  N   LIG    1       -7.671   0.117   3.258  0.00  0.00    -0.325 N 
ATOM     17  H   LIG    1       -8.299   0.813   2.882  0.00  0.00    +0.145 HD
ATOM     18  H   LIG    1       -7.510   0.126   4.257  0.00  0.00    +0.145 HD
ATOM     19  C   LIG    1       -6.653  -0.411   2.507  0.00  0.00    +0.244 C 
ATOM     20  O   LIG    1       -5.712  -0.976   3.045  0.00  0.00    -0.270 OA
ENDBRANCH   7  19
ENDBRANCH   1  11
BRANCH   4  21
ATOM     21  C   LIG    1        1.955   0.789  -0.992  0.00  0.00    +0.244 C 
ATOM     22  N   LIG    1        2.694   0.227   0.030  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1        2.240  -0.471   0.605  0.00  0.00    +0.149 HD
ATOM     24  O   LIG    1        2.458   1.352  -1.958  0.00  0.00    -0.270 OA
BRANCH  22  25
ATOM     25  C   LIG    1        4.145   0.181  -0.056  0.00  0.00    +0.120 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.789  -0.119   1.308  0.00  0.00    +0.103 C 
BRANCH  26  27
ATOM     27  N   LIG    1        6.251  -0.214   1.399  0.00  0.00    -0.301 NA
ATOM     28  C   LIG    1        6.845  -1.265   0.573  0.00  0.00    +0.084 C 
ATOM     29  C   LIG    1        7.329  -0.601  -0.706  0.00  0.00    +0.017 C 
ATOM     30  C   LIG    1        7.412   0.883  -0.390  0.00  0.00    +0.017 C 
ATOM     31  C   LIG    1        6.955   1.023   1.053  0.00  0.00    +0.084 C 
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH   4  21
TORSDOF 6