REMARK  Name = BDB014056
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.243  -0.670  -0.607  0.00  0.00    -0.299 N 
ATOM      2  C   LIG    1        0.599   0.124   0.306  0.00  0.00    +0.123 C 
ATOM      3  C   LIG    1        2.015  -0.477   0.418  0.00  0.00    +0.104 C 
ATOM      4  N   LIG    1        2.753  -0.633  -0.865  0.00  0.00    -0.294 NA
ATOM      5  C   LIG    1        1.811  -0.618  -2.010  0.00  0.00    +0.104 C 
ATOM      6  C   LIG    1        0.465  -1.314  -1.720  0.00  0.00    +0.123 C 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -3.310   2.250   1.972  0.00  0.00    +0.130 C 
ATOM      8  N   LIG    1       -4.137   1.454   1.067  0.00  0.00    -0.318 N 
ATOM      9  C   LIG    1       -3.548   0.448   0.281  0.00  0.00    +0.133 A 
ATOM     10  N   LIG    1       -2.177   0.343   0.219  0.00  0.00    -0.200 NA
ATOM     11  C   LIG    1       -1.617  -0.559  -0.526  0.00  0.00    +0.200 A 
ATOM     12  N   LIG    1       -2.371  -1.440  -1.244  0.00  0.00    -0.295 N 
ATOM     13  H   LIG    1       -1.942  -2.191  -1.752  0.00  0.00    +0.172 HD
ATOM     14  C   LIG    1       -3.728  -1.459  -1.200  0.00  0.00    +0.258 A 
ATOM     15  O   LIG    1       -4.382  -2.314  -1.790  0.00  0.00    -0.267 OA
ATOM     16  C   LIG    1       -4.353  -0.397  -0.396  0.00  0.00    +0.057 A 
ATOM     17  C   LIG    1       -5.850  -0.330  -0.379  0.00  0.00    +0.045 C 
ATOM     18  C   LIG    1       -6.363   0.994   0.179  0.00  0.00    +0.024 C 
ATOM     19  C   LIG    1       -5.561   1.399   1.409  0.00  0.00    +0.106 C 
ENDBRANCH   1  11
BRANCH   4  20
ATOM     20  C   LIG    1        3.757   0.449  -1.042  0.00  0.00    +0.143 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.970   0.331  -0.134  0.00  0.00    +0.096 A 
ATOM     22  C   LIG    1        5.583  -0.901   0.115  0.00  0.00    +0.139 A 
ATOM     23  C   LIG    1        6.733  -0.947   0.890  0.00  0.00    +0.049 A 
ATOM     24  C   LIG    1        7.244   0.236   1.411  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1        6.578   1.418   1.130  0.00  0.00    +0.111 A 
ATOM     26  N   LIG    1        5.460   1.494   0.371  0.00  0.00    -0.255 NA
BRANCH  22  27
ATOM     27  O   LIG    1        5.090  -2.086  -0.356  0.00  0.00    -0.505 OA
ATOM     28  H   LIG    1        4.172  -1.907  -0.656  0.00  0.00    +0.292 HD
ENDBRANCH  22  27
ENDBRANCH  20  21
ENDBRANCH   4  20
TORSDOF 4