REMARK  Name = BDB029703
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.076   0.250   0.087  0.00  0.00    -0.326 N 
ATOM      2  C   LIG    1        1.711   1.647  -0.195  0.00  0.00    +0.120 C 
ATOM      3  C   LIG    1        0.349   2.017   0.441  0.00  0.00    +0.104 C 
ATOM      4  N   LIG    1       -0.782   1.133   0.106  0.00  0.00    -0.293 NA
ATOM      5  C   LIG    1       -0.334  -0.197  -0.348  0.00  0.00    +0.104 C 
ATOM      6  C   LIG    1        0.963  -0.682   0.343  0.00  0.00    +0.120 C 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        6.026  -1.093   0.195  0.00  0.00    +0.125 A 
ATOM      8  N   LIG    1        5.071  -1.850   0.775  0.00  0.00    -0.249 NA
ATOM      9  C   LIG    1        3.800  -1.374   0.716  0.00  0.00    +0.134 A 
ATOM     10  C   LIG    1        3.392  -0.175   0.115  0.00  0.00    +0.048 A 
ATOM     11  C   LIG    1        4.430   0.564  -0.466  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1        5.754   0.114  -0.433  0.00  0.00    +0.035 A 
BRANCH   7  16
ATOM     13  C   LIG    1        9.776  -1.091   0.725  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        8.415  -0.671   0.501  0.00  0.00    -0.313 N 
ATOM     15  H   LIG    1        8.129   0.221   0.883  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.429  -1.619   0.258  0.00  0.00    +0.262 C 
ATOM     17  O   LIG    1        7.671  -2.813   0.116  0.00  0.00    -0.269 OA
ENDBRANCH   7  16
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  C   LIG    1       -1.821   1.763  -0.730  0.00  0.00    +0.085 C 
ATOM     19  C   LIG    1       -1.345   2.164  -2.138  0.00  0.00    +0.029 C 
BRANCH  18  20
ATOM     20  C   LIG    1       -3.113   0.955  -0.700  0.00  0.00    -0.010 A 
ATOM     21  C   LIG    1       -3.830   0.843   0.503  0.00  0.00    +0.034 A 
ATOM     22  C   LIG    1       -5.002   0.100   0.538  0.00  0.00    +0.068 A 
ATOM     23  C   LIG    1       -5.435  -0.519  -0.631  0.00  0.00    +0.088 A 
ATOM     24  C   LIG    1       -6.666  -1.301  -0.601  0.00  0.00    +0.038 A 
ATOM     25  C   LIG    1       -7.374  -1.427   0.535  0.00  0.00    +0.016 A 
ATOM     26  C   LIG    1       -6.904  -0.761   1.793  0.00  0.00    +0.252 A 
ATOM     27  O   LIG    1       -7.527  -0.857   2.845  0.00  0.00    -0.268 OA
ATOM     28  C   LIG    1       -8.642  -2.214   0.632  0.00  0.00    +0.049 C 
ATOM     29  N   LIG    1       -4.777  -0.443  -1.806  0.00  0.00    -0.253 NA
ATOM     30  N   LIG    1       -5.743  -0.036   1.717  0.00  0.00    -0.321 N 
ATOM     31  H   LIG    1       -5.436   0.405   2.573  0.00  0.00    +0.169 HD
ATOM     32  C   LIG    1       -3.635   0.287  -1.810  0.00  0.00    +0.116 A 
ENDBRANCH  18  20
ENDBRANCH   4  18
TORSDOF 4