REMARK  Name = BDB027061
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.915  -0.015  -1.066  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.855   1.418  -0.545  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.565   1.815   0.601  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.492   3.131   1.061  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -0.712   4.066   0.385  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.005   3.688  -0.755  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.076   2.373  -1.218  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  N   LIG    1       -0.382  -1.001  -0.092  0.00  0.00    -0.303 NA
ATOM      9  H   LIG    1       -0.920  -0.911   0.771  0.00  0.00    +0.123 HD
BRANCH   8  10
ATOM     10  C   LIG    1        1.040  -0.828   0.237  0.00  0.00    +0.086 C 
BRANCH  10  11
ATOM     11  C   LIG    1        2.001  -1.097  -0.929  0.00  0.00    +0.050 C 
BRANCH  11  15
ATOM     12  C   LIG    1        6.115  -0.844   0.374  0.00  0.00    +0.037 A 
ATOM     13  C   LIG    1        5.485  -2.088   0.265  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        4.156  -2.171  -0.158  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        3.444  -1.012  -0.487  0.00  0.00    -0.046 A 
ATOM     16  C   LIG    1        4.081   0.233  -0.386  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        5.411   0.318   0.038  0.00  0.00    +0.013 A 
BRANCH  12  21
ATOM     18  N   LIG    1        7.995   0.362   1.363  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        7.372   1.083   1.696  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        8.915   0.316   1.783  0.00  0.00    +0.145 HD
ATOM     21  C   LIG    1        7.531  -0.809   0.830  0.00  0.00    +0.242 C 
ATOM     22  O   LIG    1        8.253  -1.796   0.770  0.00  0.00    -0.270 OA
ENDBRANCH  12  21
ENDBRANCH  11  15
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   1  23
ATOM     23  C   LIG    1       -2.352  -0.341  -1.565  0.00  0.00    +0.186 C 
ATOM     24  O   LIG    1       -2.721   0.089  -2.664  0.00  0.00    -0.290 OA
BRANCH  23  25
ATOM     25  C   LIG    1       -3.318  -1.035  -0.706  0.00  0.00    +0.044 A 
ATOM     26  C   LIG    1       -4.655  -0.606  -0.417  0.00  0.00    +0.010 A 
ATOM     27  C   LIG    1       -5.231  -1.555   0.428  0.00  0.00    +0.047 A 
ATOM     28  C   LIG    1       -6.535  -1.439   0.922  0.00  0.00    +0.026 A 
ATOM     29  C   LIG    1       -7.275  -0.315   0.542  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1       -6.730   0.650  -0.302  0.00  0.00    +0.001 A 
ATOM     31  N   LIG    1       -4.295  -2.543   0.622  0.00  0.00    -0.360 N 
ATOM     32  H   LIG    1       -4.448  -3.376   1.173  0.00  0.00    +0.165 HD
ATOM     33  C   LIG    1       -5.425   0.517  -0.787  0.00  0.00    +0.011 A 
ATOM     34  C   LIG    1       -3.144  -2.244  -0.057  0.00  0.00    +0.095 A 
ENDBRANCH  23  25
ENDBRANCH   1  23
TORSDOF 8