REMARK  Name = BDB007715
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.432   2.276   2.002  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1       -1.846   1.841  -0.429  0.00  0.00    -0.270 OA
ATOM      3  C   LIG    1       -2.178   1.222   0.575  0.00  0.00    +0.244 C 
ATOM      4  N   LIG    1       -1.498   1.306   1.773  0.00  0.00    -0.309 N 
ATOM      5  H   LIG    1       -1.990   0.987   2.598  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1       -3.376   0.338   0.550  0.00  0.00    +0.037 A 
ATOM      7  C   LIG    1       -4.390   0.628  -0.377  0.00  0.00    +0.020 A 
ATOM      8  C   LIG    1       -5.508  -0.188  -0.404  0.00  0.00    -0.002 A 
ATOM      9  C   LIG    1       -6.682  -0.154  -1.303  0.00  0.00    +0.080 C 
ATOM     10  C   LIG    1       -7.586  -1.137  -0.556  0.00  0.00    +0.234 C 
ATOM     11  O   LIG    1       -6.771  -1.992   0.281  0.00  0.00    -0.491 OA
ATOM     12  C   LIG    1       -5.615  -1.276   0.448  0.00  0.00    +0.124 A 
ATOM     13  C   LIG    1       -4.622  -1.601   1.349  0.00  0.00    +0.046 A 
ATOM     14  C   LIG    1       -3.489  -0.783   1.400  0.00  0.00    +0.016 A 
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  15
ATOM     15  C   LIG    1        0.821   2.162   1.102  0.00  0.00    +0.145 C 
BRANCH  15  16
ATOM     16  O   LIG    1        0.591   2.810  -0.153  0.00  0.00    -0.389 OA
ATOM     17  H   LIG    1       -0.229   2.420  -0.529  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
BRANCH  15  18
ATOM     18  C   LIG    1        1.284   0.697   0.906  0.00  0.00    +0.117 C 
BRANCH  18  19
ATOM     19  N   LIG    1        2.559   0.528   0.176  0.00  0.00    -0.295 NA
ATOM     20  C   LIG    1        2.734  -0.887  -0.206  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1        4.084  -1.207  -0.814  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1        5.180  -0.347  -0.635  0.00  0.00    -0.042 A 
ATOM     23  C   LIG    1        6.426  -0.680  -1.183  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1        6.590  -1.875  -1.882  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.512  -2.741  -2.045  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        4.992   0.962   0.085  0.00  0.00    +0.051 C 
ATOM     27  C   LIG    1        4.265  -2.411  -1.512  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        3.723   0.983   0.949  0.00  0.00    +0.089 C 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 6