REMARK  Name = BDB030266
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.646  -0.183  -1.012  0.00  0.00    +0.037 C 
ATOM      2  C   LIG    1       -0.748   0.380   0.056  0.00  0.00    +0.121 C 
ATOM      3  N   LIG    1        0.589  -0.102  -0.274  0.00  0.00    -0.295 N 
ATOM      4  C   LIG    1        1.656   0.230   0.550  0.00  0.00    +0.267 C 
ATOM      5  O   LIG    1        1.462   0.867   1.590  0.00  0.00    -0.268 OA
ATOM      6  C   LIG    1        0.641  -0.819  -1.541  0.00  0.00    +0.112 C 
ATOM      7  C   LIG    1       -0.785  -0.939  -1.974  0.00  0.00    +0.021 C 
ATOM      8  C   LIG    1       -1.798  -1.687  -1.151  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -6.037   2.421  -1.729  0.00  0.00    +0.090 C 
ATOM     10  C   LIG    1       -4.718   1.758  -1.747  0.00  0.00    +0.144 A 
ATOM     11  C   LIG    1       -4.069   0.850  -0.935  0.00  0.00    +0.066 A 
ATOM     12  C   LIG    1       -2.800   0.719  -1.541  0.00  0.00    +0.101 A 
ATOM     13  N   LIG    1       -2.689   1.447  -2.656  0.00  0.00    -0.082 NA
ATOM     14  O   LIG    1       -3.901   2.103  -2.781  0.00  0.00    -0.359 OA
BRANCH  11  15
ATOM     15  C   LIG    1       -4.602   0.259   0.270  0.00  0.00    +0.076 A 
ATOM     16  N   LIG    1       -3.771   0.265   1.337  0.00  0.00    -0.255 NA
ATOM     17  C   LIG    1       -4.228  -0.284   2.484  0.00  0.00    +0.111 A 
ATOM     18  C   LIG    1       -5.484  -0.850   2.617  0.00  0.00    +0.020 A 
ATOM     19  C   LIG    1       -6.322  -0.857   1.508  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -5.878  -0.296   0.313  0.00  0.00    +0.028 A 
ENDBRANCH  11  15
ENDBRANCH   1  12
BRANCH   4  21
ATOM     21  C   LIG    1        3.035  -0.178   0.188  0.00  0.00    +0.147 A 
ATOM     22  N   LIG    1        3.387  -0.858  -0.920  0.00  0.00    -0.169 NA
ATOM     23  N   LIG    1        4.718  -0.994  -0.832  0.00  0.00    -0.281 N 
ATOM     24  H   LIG    1        5.199  -1.482  -1.580  0.00  0.00    +0.189 HD
ATOM     25  C   LIG    1        5.261  -0.437   0.290  0.00  0.00    +0.039 A 
ATOM     26  C   LIG    1        4.192   0.102   0.972  0.00  0.00    +0.057 A 
BRANCH  25  27
ATOM     27  C   LIG    1        6.729  -0.479   0.580  0.00  0.00    +0.031 C 
ATOM     28  C   LIG    1        7.315   0.932   0.641  0.00  0.00    +0.014 C 
ATOM     29  C   LIG    1        7.008  -1.238   1.877  0.00  0.00    +0.014 C 
ENDBRANCH  25  27
ENDBRANCH   4  21
TORSDOF 4