REMARK  Name = BDB056481
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.731  -1.065   0.232  0.00  0.00    +0.001 A 
ATOM      2  C   LIG    1        0.437  -0.523   0.283  0.00  0.00    +0.022 A 
ATOM      3  C   LIG    1       -0.609  -1.304   0.812  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1       -0.282  -2.583   1.245  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -1.422  -3.179   1.705  0.00  0.00    -0.345 N 
ATOM      6  H   LIG    1       -1.449  -4.116   2.079  0.00  0.00    +0.167 HD
ATOM      7  C   LIG    1       -2.482  -2.318   1.579  0.00  0.00    +0.093 A 
ATOM      8  N   LIG    1        0.927  -3.171   1.232  0.00  0.00    -0.237 NA
ATOM      9  C   LIG    1       -2.012  -1.137   1.028  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        1.893  -2.367   0.719  0.00  0.00    +0.121 A 
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1        5.026   1.173  -1.336  0.00  0.00    +0.117 A 
ATOM     12  C   LIG    1        4.223   1.733  -0.350  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1        3.147   0.999   0.159  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1        2.863  -0.297  -0.308  0.00  0.00    -0.016 A 
ATOM     15  C   LIG    1        3.693  -0.834  -1.308  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1        4.769  -0.103  -1.819  0.00  0.00    +0.046 A 
BRANCH  11  17
ATOM     17  O   LIG    1        6.085   1.850  -1.862  0.00  0.00    -0.507 OA
ATOM     18  H   LIG    1        6.138   2.722  -1.437  0.00  0.00    +0.292 HD
ENDBRANCH  11  17
ENDBRANCH   1  14
BRANCH   9  19
ATOM     19  C   LIG    1       -2.865   0.011   0.773  0.00  0.00    -0.016 A 
ATOM     20  C   LIG    1       -2.483   1.284   1.217  0.00  0.00    +0.012 A 
ATOM     21  C   LIG    1       -3.297   2.391   0.969  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1       -4.492   2.227   0.278  0.00  0.00    +0.117 A 
ATOM     23  C   LIG    1       -4.889   0.971  -0.170  0.00  0.00    +0.046 A 
ATOM     24  C   LIG    1       -4.074  -0.137   0.080  0.00  0.00    +0.012 A 
BRANCH  22  25
ATOM     25  O   LIG    1       -5.255   3.334   0.057  0.00  0.00    -0.507 OA
ATOM     26  H   LIG    1       -6.050   3.070  -0.434  0.00  0.00    +0.292 HD
ENDBRANCH  22  25
ENDBRANCH   9  19
TORSDOF 4