REMARK  Name = BDB062480
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.336   0.868  -1.104  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1        0.896   1.152  -1.849  0.00  0.00    +0.107 C 
ATOM      3  C   LIG    1        2.017   0.545  -0.980  0.00  0.00    +0.086 C 
ATOM      4  C   LIG    1        1.396   0.476   0.421  0.00  0.00    +0.039 C 
ATOM      5  C   LIG    1        0.030   1.135   0.291  0.00  0.00    +0.086 C 
ENDROOT
BRANCH   3   6
ATOM      6  N   LIG    1        3.216   1.392  -0.997  0.00  0.00    -0.339 N 
ATOM      7  H   LIG    1        3.301   1.956  -1.841  0.00  0.00    +0.146 HD
BRANCH   6   8
ATOM      8  C   LIG    1        4.459   0.873  -0.617  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1        4.658  -0.288   0.134  0.00  0.00    +0.134 A 
ATOM     10  N   LIG    1        5.860  -0.755   0.558  0.00  0.00    -0.249 NA
ATOM     11  C   LIG    1        6.943   0.004   0.239  0.00  0.00    +0.125 A 
ATOM     12  C   LIG    1        6.864   1.194  -0.466  0.00  0.00    +0.035 A 
ATOM     13  C   LIG    1        5.606   1.630  -0.882  0.00  0.00    +0.027 A 
BRANCH  11  14
ATOM     14  C   LIG    1        8.274  -0.503   0.708  0.00  0.00    +0.262 C 
ATOM     15  N   LIG    1        8.217  -1.707   1.377  0.00  0.00    -0.313 N 
ATOM     16  H   LIG    1        7.284  -2.066   1.564  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        9.364  -2.289   2.017  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1        9.307   0.126   0.507  0.00  0.00    -0.269 OA
ENDBRANCH  11  14
ENDBRANCH   6   8
ENDBRANCH   3   6
BRANCH   1  19
ATOM     19  C   LIG    1       -1.459   1.687  -1.570  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.963  -0.874   0.794  0.00  0.00    +0.019 A 
ATOM     21  C   LIG    1       -6.180  -1.971   0.135  0.00  0.00    +0.252 A 
ATOM     22  O   LIG    1       -6.586  -3.128   0.102  0.00  0.00    -0.268 OA
ATOM     23  N   LIG    1       -4.981  -1.626  -0.434  0.00  0.00    -0.321 N 
ATOM     24  H   LIG    1       -4.465  -2.376  -0.875  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1       -4.467  -0.325  -0.410  0.00  0.00    +0.068 A 
ATOM     26  C   LIG    1       -5.184   0.694   0.213  0.00  0.00    +0.088 A 
ATOM     27  N   LIG    1       -4.762   1.974   0.284  0.00  0.00    -0.253 NA
ATOM     28  C   LIG    1       -3.567   2.243  -0.294  0.00  0.00    +0.116 A 
ATOM     29  C   LIG    1       -2.771   1.295  -0.938  0.00  0.00    -0.013 A 
ATOM     30  C   LIG    1       -3.247  -0.021  -0.997  0.00  0.00    +0.034 A 
ATOM     31  C   LIG    1       -6.467   0.376   0.830  0.00  0.00    +0.038 A 
BRANCH  20  33
ATOM     32  C   LIG    1       -9.387  -1.409   0.403  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1       -8.274  -1.249   1.429  0.00  0.00    +0.037 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 6