REMARK  Name = BDB004607
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.714   2.244  -0.283  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.274   2.164   0.172  0.00  0.00    -0.029 A 
ATOM      3  C   LIG    1        0.650   1.375  -0.538  0.00  0.00    +0.028 A 
ATOM      4  C   LIG    1        1.991   1.266  -0.137  0.00  0.00    +0.034 A 
ATOM      5  C   LIG    1        2.404   1.984   0.983  0.00  0.00    +0.023 A 
ATOM      6  C   LIG    1        1.494   2.771   1.701  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1        0.162   2.857   1.303  0.00  0.00    +0.005 A 
BRANCH   4   8
ATOM      8  N   LIG    1        2.805   0.446  -0.938  0.00  0.00    -0.285 N 
ATOM      9  H   LIG    1        2.379   0.104  -1.794  0.00  0.00    +0.155 HD
ATOM     10  C   LIG    1        4.084  -0.028  -0.850  0.00  0.00    +0.222 C 
ATOM     11  O   LIG    1        4.499  -0.668  -1.822  0.00  0.00    -0.275 OA
BRANCH  10  12
ATOM     12  C   LIG    1        4.929   0.214   0.384  0.00  0.00    +0.131 C 
BRANCH  12  13
ATOM     13  C   LIG    1        6.180  -0.634   0.463  0.00  0.00    -0.039 A 
ATOM     14  C   LIG    1        7.369  -0.207  -0.144  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        8.521  -0.992  -0.073  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        8.495  -2.212   0.600  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        7.316  -2.651   1.199  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        6.162  -1.868   1.129  0.00  0.00    +0.004 A 
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19  N   LIG    1       -2.331   0.934  -0.110  0.00  0.00    -0.324 N 
ATOM     20  H   LIG    1       -2.229   0.613   0.849  0.00  0.00    +0.148 HD
BRANCH  19  24
ATOM     21  C   LIG    1       -6.453  -1.574  -0.567  0.00  0.00    +0.063 A 
ATOM     22  C   LIG    1       -5.742  -0.364  -0.710  0.00  0.00    +0.088 A 
ATOM     23  C   LIG    1       -4.382  -0.362  -0.342  0.00  0.00    +0.041 A 
ATOM     24  C   LIG    1       -3.692   0.862  -0.477  0.00  0.00    +0.130 A 
ATOM     25  N   LIG    1       -4.278   1.963  -0.970  0.00  0.00    -0.220 NA
ATOM     26  C   LIG    1       -5.563   1.859  -1.300  0.00  0.00    +0.223 A 
ATOM     27  C   LIG    1       -3.767  -1.551   0.127  0.00  0.00    +0.013 A 
ATOM     28  C   LIG    1       -4.484  -2.732   0.254  0.00  0.00    +0.002 A 
ATOM     29  N   LIG    1       -6.321   0.762  -1.184  0.00  0.00    -0.235 NA
ATOM     30  C   LIG    1       -5.827  -2.741  -0.088  0.00  0.00    +0.015 A 
BRANCH  21  34
ATOM     31  N   LIG    1       -8.578  -0.625  -1.365  0.00  0.00    -0.325 N 
ATOM     32  H   LIG    1       -8.101   0.261  -1.501  0.00  0.00    +0.145 HD
ATOM     33  H   LIG    1       -9.550  -0.720  -1.622  0.00  0.00    +0.145 HD
ATOM     34  C   LIG    1       -7.904  -1.719  -0.909  0.00  0.00    +0.244 C 
ATOM     35  O   LIG    1       -8.489  -2.790  -0.787  0.00  0.00    -0.270 OA
ENDBRANCH  21  34
ENDBRANCH  19  24
ENDBRANCH   1  19
TORSDOF 7