REMARK  Name = BDB062474
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.307  -0.656  -1.025  0.00  0.00    -0.297 NA
ATOM      2  C   LIG    1        0.071   0.372  -0.013  0.00  0.00    +0.090 C 
ATOM      3  C   LIG    1       -0.592  -0.360   1.161  0.00  0.00    +0.026 C 
ATOM      4  C   LIG    1       -0.796  -1.788   0.666  0.00  0.00    +0.026 C 
ATOM      5  C   LIG    1       -2.216  -1.787   0.088  0.00  0.00    +0.110 C 
ATOM      6  N   LIG    1       -2.912  -0.730   0.820  0.00  0.00    -0.328 N 
ATOM      7  C   LIG    1       -1.984   0.129   1.548  0.00  0.00    +0.110 C 
ATOM      8  C   LIG    1        0.299  -1.958  -0.373  0.00  0.00    +0.090 C 
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1       -4.263  -0.498   0.720  0.00  0.00    +0.048 A 
ATOM     10  C   LIG    1       -5.110  -1.232  -0.120  0.00  0.00    +0.134 A 
ATOM     11  N   LIG    1       -6.449  -1.057  -0.263  0.00  0.00    -0.249 NA
ATOM     12  C   LIG    1       -7.012  -0.084   0.485  0.00  0.00    +0.125 A 
ATOM     13  C   LIG    1       -6.286   0.709   1.362  0.00  0.00    +0.035 A 
ATOM     14  C   LIG    1       -4.909   0.492   1.471  0.00  0.00    +0.027 A 
BRANCH  12  15
ATOM     15  C   LIG    1       -8.491   0.111   0.327  0.00  0.00    +0.262 C 
ATOM     16  N   LIG    1       -8.925   1.431   0.327  0.00  0.00    -0.313 N 
ATOM     17  H   LIG    1       -8.239   2.154   0.159  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1      -10.304   1.734   0.037  0.00  0.00    +0.128 C 
ATOM     19  O   LIG    1       -9.252  -0.841   0.191  0.00  0.00    -0.269 OA
ENDBRANCH  12  15
ENDBRANCH   6   9
BRANCH   1  20
ATOM     20  C   LIG    1        1.349  -0.402  -2.010  0.00  0.00    +0.121 C 
BRANCH  20  30
ATOM     21  C   LIG    1        7.373   0.514   0.302  0.00  0.00    +0.019 A 
ATOM     22  C   LIG    1        6.669   1.839   0.287  0.00  0.00    +0.252 A 
ATOM     23  O   LIG    1        7.217   2.870   0.664  0.00  0.00    -0.268 OA
ATOM     24  N   LIG    1        5.376   1.854  -0.168  0.00  0.00    -0.321 N 
ATOM     25  H   LIG    1        4.918   2.755  -0.171  0.00  0.00    +0.169 HD
ATOM     26  C   LIG    1        4.709   0.709  -0.618  0.00  0.00    +0.068 A 
ATOM     27  C   LIG    1        5.363  -0.520  -0.618  0.00  0.00    +0.088 A 
ATOM     28  N   LIG    1        4.797  -1.670  -1.039  0.00  0.00    -0.253 NA
ATOM     29  C   LIG    1        3.518  -1.582  -1.475  0.00  0.00    +0.116 A 
ATOM     30  C   LIG    1        2.771  -0.403  -1.508  0.00  0.00    -0.013 A 
ATOM     31  C   LIG    1        3.397   0.771  -1.071  0.00  0.00    +0.034 A 
ATOM     32  C   LIG    1        6.740  -0.586  -0.142  0.00  0.00    +0.038 A 
BRANCH  21  34
ATOM     33  C   LIG    1        8.888   0.545   2.308  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1        8.796   0.496   0.789  0.00  0.00    +0.037 C 
ENDBRANCH  21  34
ENDBRANCH  20  30
ENDBRANCH   1  20
TORSDOF 5