REMARK  Name = BDB026694
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.072  -0.901   0.343  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.679   0.404   0.668  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.324   0.751   0.561  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        1.740   1.966   0.773  0.00  0.00    -0.227 NA
ATOM      5  C   LIG    1        0.444   1.792   0.577  0.00  0.00    +0.148 A 
ATOM      6  N   LIG    1        0.170   0.484   0.167  0.00  0.00    -0.292 N 
ATOM      7  C   LIG    1        1.385  -0.201   0.175  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        1.768  -1.509  -0.173  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        3.124  -1.845  -0.067  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -1.093  -0.052  -0.219  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -1.462  -1.344   0.181  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -2.710  -1.865  -0.188  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -3.095  -3.278   0.154  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -4.602  -3.423   0.285  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -5.337  -2.785  -0.871  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -4.811  -1.618  -1.357  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -5.381  -1.128  -2.035  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -6.402  -3.225  -1.297  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.575  -1.093  -0.970  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -3.206   0.183  -1.387  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -1.970   0.709  -1.005  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   5  22
ATOM     22  C   LIG    1       -0.549   2.850   0.822  0.00  0.00    +0.038 A 
ATOM     23  C   LIG    1       -0.445   4.096   0.166  0.00  0.00    +0.035 A 
ATOM     24  C   LIG    1       -1.460   5.044   0.350  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1       -2.500   4.814   1.253  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1       -2.557   3.617   1.960  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -1.588   2.638   1.744  0.00  0.00    +0.013 A 
BRANCH  23  28
ATOM     28  N   LIG    1        0.524   4.323  -0.836  0.00  0.00    -0.357 N 
ATOM     29  H   LIG    1        0.748   5.306  -0.950  0.00  0.00    +0.142 HD
ATOM     30  H   LIG    1        1.370   3.778  -0.643  0.00  0.00    +0.142 HD
ENDBRANCH  23  28
ENDBRANCH   5  22
BRANCH   1  34
ATOM     31  C   LIG    1        7.394  -2.510  -0.469  0.00  0.00    +0.128 C 
ATOM     32  N   LIG    1        5.987  -2.201  -0.417  0.00  0.00    -0.314 N 
ATOM     33  H   LIG    1        5.428  -2.429  -1.228  0.00  0.00    +0.149 HD
ATOM     34  C   LIG    1        5.515  -1.244   0.460  0.00  0.00    +0.244 C 
ATOM     35  O   LIG    1        6.222  -0.667   1.277  0.00  0.00    -0.270 OA
ENDBRANCH   1  34
TORSDOF 4