REMARK  Name = BDB060780
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.961   1.675   0.959  0.00  0.00    -0.284 N 
ATOM      2  H   LIG    1        0.296   2.358   1.292  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   1   5
ATOM      3  C   LIG    1       -1.527  -0.670  -0.550  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1       -0.900   0.465   0.002  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        0.435   0.475   0.462  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1        1.177  -0.695   0.331  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1        0.601  -1.839  -0.214  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1       -0.728  -1.820  -0.645  0.00  0.00    +0.023 A 
BRANCH   3  14
ATOM      9  C   LIG    1       -8.010  -0.277   0.654  0.00  0.00    +0.109 C 
ATOM     10  C   LIG    1       -7.231  -1.080  -0.356  0.00  0.00    +0.213 C 
ATOM     11  N   LIG    1       -5.849  -1.128  -0.215  0.00  0.00    -0.300 N 
ATOM     12  C   LIG    1       -5.109  -1.849  -1.265  0.00  0.00    +0.126 C 
ATOM     13  C   LIG    1       -3.575  -1.950  -1.116  0.00  0.00    +0.124 C 
ATOM     14  N   LIG    1       -2.851  -0.661  -0.992  0.00  0.00    -0.328 N 
ATOM     15  C   LIG    1       -3.616   0.581  -1.118  0.00  0.00    +0.106 C 
ATOM     16  C   LIG    1       -4.420   0.882   0.146  0.00  0.00    +0.038 C 
ATOM     17  C   LIG    1       -5.088  -0.345   0.761  0.00  0.00    +0.109 C 
ATOM     18  O   LIG    1       -7.819  -1.668  -1.264  0.00  0.00    -0.276 OA
ENDBRANCH   3  14
ENDBRANCH   1   5
BRANCH   1  19
ATOM     19  C   LIG    1        2.242   2.082   1.318  0.00  0.00    +0.220 A 
ATOM     20  N   LIG    1        3.328   1.390   0.955  0.00  0.00    -0.213 NA
ATOM     21  C   LIG    1        4.535   1.865   1.333  0.00  0.00    +0.097 A 
ATOM     22  C   LIG    1        4.678   3.018   2.073  0.00  0.00    +0.050 A 
ATOM     23  C   LIG    1        3.513   3.667   2.387  0.00  0.00    +0.116 A 
ATOM     24  N   LIG    1        2.297   3.228   2.017  0.00  0.00    -0.223 NA
BRANCH  21  25
ATOM     25  C   LIG    1        5.714   1.087   0.924  0.00  0.00    +0.118 A 
ATOM     26  C   LIG    1        5.807   0.108  -0.119  0.00  0.00    +0.029 A 
ATOM     27  C   LIG    1        7.123  -0.340  -0.086  0.00  0.00    +0.066 A 
ATOM     28  C   LIG    1        7.627  -1.315  -0.953  0.00  0.00    +0.028 A 
ATOM     29  C   LIG    1        6.744  -1.849  -1.897  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1        5.420  -1.418  -1.966  0.00  0.00    +0.001 A 
ATOM     31  N   LIG    1        7.714   0.369   0.920  0.00  0.00    -0.276 N 
ATOM     32  H   LIG    1        8.676   0.303   1.232  0.00  0.00    +0.189 HD
ATOM     33  C   LIG    1        4.939  -0.440  -1.087  0.00  0.00    +0.012 A 
ATOM     34  N   LIG    1        6.906   1.246   1.535  0.00  0.00    -0.171 NA
ENDBRANCH  21  25
ENDBRANCH   1  19
TORSDOF 4