REMARK  Name = BDB056277
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.793  -1.084   0.693  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.553  -2.201  -0.116  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1       -0.506  -2.181  -1.024  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1       -1.338  -1.057  -1.097  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -1.098   0.060  -0.288  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1       -0.038   0.040   0.620  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        1.600  -0.881   2.855  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.896  -1.087   1.680  0.00  0.00    +0.247 C 
ATOM      9  N   LIG    1        3.202  -1.306   1.237  0.00  0.00    -0.297 N 
ATOM     10  C   LIG    1        3.604  -1.249  -0.175  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1        5.067  -0.875  -0.430  0.00  0.00    +0.038 C 
ATOM     12  C   LIG    1        5.438   0.553   0.015  0.00  0.00    +0.058 C 
ATOM     13  C   LIG    1        4.901   0.973   1.402  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1        4.918  -0.057   2.538  0.00  0.00    +0.020 C 
ATOM     15  C   LIG    1        4.252  -1.401   2.243  0.00  0.00    +0.108 C 
BRANCH  12  16
ATOM     16  N   LIG    1        6.877   0.744  -0.223  0.00  0.00    -0.299 NA
ATOM     17  C   LIG    1        7.272   2.131  -0.472  0.00  0.00    +0.085 C 
ATOM     18  C   LIG    1        8.795   2.092  -0.398  0.00  0.00    +0.017 C 
ATOM     19  C   LIG    1        9.133   0.761   0.265  0.00  0.00    +0.017 C 
ATOM     20  C   LIG    1        7.801   0.251   0.791  0.00  0.00    +0.085 C 
ENDBRANCH  12  16
ENDBRANCH   1   8
BRANCH   4  21
ATOM     21  C   LIG    1       -2.440  -1.052  -2.086  0.00  0.00    +0.247 C 
ATOM     22  N   LIG    1       -3.734  -0.766  -1.656  0.00  0.00    -0.297 N 
ATOM     23  C   LIG    1       -4.169  -0.797  -0.255  0.00  0.00    +0.109 C 
ATOM     24  C   LIG    1       -5.577  -1.363  -0.112  0.00  0.00    +0.038 C 
ATOM     25  C   LIG    1       -6.619  -0.592  -0.950  0.00  0.00    +0.060 C 
ATOM     26  C   LIG    1       -5.978   0.132  -2.151  0.00  0.00    +0.038 C 
ATOM     27  C   LIG    1       -4.774  -0.641  -2.674  0.00  0.00    +0.109 C 
ATOM     28  O   LIG    1       -2.153  -1.296  -3.256  0.00  0.00    -0.270 OA
BRANCH  25  29
ATOM     29  N   LIG    1       -7.499   0.232  -0.108  0.00  0.00    -0.299 NA
ATOM     30  C   LIG    1       -6.873   1.309   0.654  0.00  0.00    +0.085 C 
ATOM     31  C   LIG    1       -8.060   2.121   1.159  0.00  0.00    +0.017 C 
ATOM     32  C   LIG    1       -9.230   1.733   0.262  0.00  0.00    +0.017 C 
ATOM     33  C   LIG    1       -8.623   0.846  -0.811  0.00  0.00    +0.085 C 
ENDBRANCH  25  29
ENDBRANCH   4  21
TORSDOF 4