REMARK  Name = BDB026868
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.715   0.009  -0.319  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.676   1.526  -0.183  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -0.336   2.115   1.046  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -0.280   3.503   1.179  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -0.563   4.320   0.087  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.902   3.752  -1.139  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.958   2.364  -1.275  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -2.292  -0.626  -2.053  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -2.109  -0.456  -0.842  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -3.202  -0.658   0.122  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -4.528  -1.136  -0.165  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -5.237  -1.168   1.037  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -6.571  -1.587   1.124  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -7.203  -1.989  -0.056  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -6.527  -1.971  -1.272  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -4.387  -0.725   2.020  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -4.640  -0.638   2.995  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -5.194  -1.548  -1.339  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -3.163  -0.419   1.486  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        0.332  -0.529  -1.231  0.00  0.00    -0.301 NA
ATOM     21  H   LIG    1        0.060  -0.280  -2.187  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.706  -0.091  -0.971  0.00  0.00    +0.103 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.278  -0.584   0.362  0.00  0.00    +0.138 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.645  -0.140   0.556  0.00  0.00    -0.329 N 
ATOM     25  C   LIG    1        4.787  -0.800   0.177  0.00  0.00    +0.069 A 
ATOM     26  C   LIG    1        5.815   0.038   0.607  0.00  0.00    +0.089 A 
ATOM     27  C   LIG    1        7.148  -0.335   0.378  0.00  0.00    +0.030 A 
ATOM     28  C   LIG    1        7.408  -1.543  -0.280  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        6.361  -2.364  -0.703  0.00  0.00    +0.002 A 
ATOM     30  N   LIG    1        5.315   1.161   1.220  0.00  0.00    -0.236 NA
ATOM     31  C   LIG    1        5.024  -2.011  -0.484  0.00  0.00    +0.028 A 
ATOM     32  C   LIG    1        4.010   1.026   1.171  0.00  0.00    +0.200 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7