REMARK  Name = BDB028270
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.030   1.010   0.386  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -0.885  -0.032   0.137  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -2.250   0.236  -0.045  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.707   1.548   0.019  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -4.140   1.822  -0.172  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.937   0.729  -0.405  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -5.930   0.898  -0.539  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -4.525  -0.566  -0.472  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -4.583   2.963  -0.123  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -1.816   2.596   0.263  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -3.258  -0.824  -0.305  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -0.458   2.326   0.445  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  18
ATOM     13  C   LIG    1        4.625  -0.906  -0.803  0.00  0.00    +0.078 A 
ATOM     14  C   LIG    1        3.563  -0.243  -0.130  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1        4.099   0.270   1.045  0.00  0.00    +0.139 A 
ATOM     16  N   LIG    1        3.463   0.975   1.995  0.00  0.00    -0.237 NA
ATOM     17  C   LIG    1        2.151   1.174   1.712  0.00  0.00    +0.121 A 
ATOM     18  C   LIG    1        1.461   0.728   0.578  0.00  0.00    +0.001 A 
ATOM     19  N   LIG    1        5.426  -0.063   1.093  0.00  0.00    -0.345 N 
ATOM     20  H   LIG    1        6.040   0.196   1.852  0.00  0.00    +0.167 HD
ATOM     21  C   LIG    1        2.196  -0.005  -0.370  0.00  0.00    +0.022 A 
ATOM     22  C   LIG    1        5.763  -0.781  -0.028  0.00  0.00    +0.104 A 
BRANCH  13  24
ATOM     23  N   LIG    1        4.486  -2.140  -3.075  0.00  0.00    -0.191 NA
ATOM     24  C   LIG    1        4.555  -1.588  -2.057  0.00  0.00    +0.101 C 
ENDBRANCH  13  24
ENDBRANCH   1  18
BRANCH  11  25
ATOM     25  C   LIG    1       -2.784  -2.279  -0.378  0.00  0.00    +0.136 C 
BRANCH  25  26
ATOM     26  N   LIG    1       -3.905  -3.187  -0.646  0.00  0.00    -0.325 NA
ATOM     27  H   LIG    1       -4.617  -3.017   0.069  0.00  0.00    +0.119 HD
ATOM     28  H   LIG    1       -4.362  -2.869  -1.504  0.00  0.00    +0.119 HD
ENDBRANCH  25  26
ENDBRANCH  11  25
TORSDOF 4