REMARK  Name = BDB005105
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.931  -0.718  -1.747  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.169  -1.411  -0.973  0.00  0.00    -0.029 A 
ATOM      3  C   LIG    1       -1.255  -0.684  -0.457  0.00  0.00    +0.028 A 
ATOM      4  C   LIG    1       -2.278  -1.318   0.265  0.00  0.00    +0.034 A 
ATOM      5  C   LIG    1       -2.204  -2.696   0.468  0.00  0.00    +0.023 A 
ATOM      6  C   LIG    1       -1.133  -3.432  -0.045  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -0.123  -2.795  -0.763  0.00  0.00    +0.005 A 
BRANCH   4   8
ATOM      8  N   LIG    1       -3.328  -0.502   0.739  0.00  0.00    -0.285 N 
ATOM      9  H   LIG    1       -3.265   0.476   0.490  0.00  0.00    +0.155 HD
ATOM     10  C   LIG    1       -4.428  -0.890   1.485  0.00  0.00    +0.222 C 
ATOM     11  O   LIG    1       -4.670  -2.029   1.878  0.00  0.00    -0.275 OA
BRANCH  10  12
ATOM     12  C   LIG    1       -5.392   0.247   1.822  0.00  0.00    +0.089 C 
ATOM     13  C   LIG    1       -4.711   1.300   2.702  0.00  0.00    +0.093 C 
ATOM     14  N   LIG    1       -5.585   2.404   3.107  0.00  0.00    -0.315 NA
ATOM     15  H   LIG    1       -5.957   2.233   4.042  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -6.696   2.665   2.190  0.00  0.00    +0.081 C 
ATOM     17  C   LIG    1       -6.345   2.347   0.741  0.00  0.00    +0.016 C 
ATOM     18  C   LIG    1       -6.021   0.864   0.563  0.00  0.00    +0.015 C 
ENDBRANCH  10  12
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19  N   LIG    1        2.198  -0.922  -1.056  0.00  0.00    -0.324 N 
ATOM     20  H   LIG    1        2.129  -0.653  -0.078  0.00  0.00    +0.148 HD
BRANCH  19  24
ATOM     21  C   LIG    1        6.938   0.076  -1.096  0.00  0.00    +0.063 A 
ATOM     22  C   LIG    1        5.658   0.223  -1.671  0.00  0.00    +0.088 A 
ATOM     23  C   LIG    1        4.588  -0.453  -1.055  0.00  0.00    +0.041 A 
ATOM     24  C   LIG    1        3.314  -0.285  -1.637  0.00  0.00    +0.130 A 
ATOM     25  N   LIG    1        3.124   0.446  -2.746  0.00  0.00    -0.220 NA
ATOM     26  C   LIG    1        4.200   1.037  -3.261  0.00  0.00    +0.223 A 
ATOM     27  C   LIG    1        4.818  -1.266   0.084  0.00  0.00    +0.013 A 
ATOM     28  C   LIG    1        6.087  -1.402   0.629  0.00  0.00    +0.002 A 
ATOM     29  N   LIG    1        5.446   0.973  -2.776  0.00  0.00    -0.235 NA
ATOM     30  C   LIG    1        7.144  -0.730   0.041  0.00  0.00    +0.015 A 
BRANCH  21  34
ATOM     31  N   LIG    1        8.015   1.655  -2.646  0.00  0.00    -0.325 N 
ATOM     32  H   LIG    1        8.848   2.022  -3.083  0.00  0.00    +0.145 HD
ATOM     33  H   LIG    1        7.119   1.758  -3.114  0.00  0.00    +0.145 HD
ATOM     34  C   LIG    1        8.161   0.747  -1.639  0.00  0.00    +0.244 C 
ATOM     35  O   LIG    1        9.278   0.500  -1.196  0.00  0.00    -0.270 OA
ENDBRANCH  21  34
ENDBRANCH  19  24
ENDBRANCH   1  19
TORSDOF 6