REMARK  Name = BDB060975
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.283   0.807  -1.966  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1       -2.933   1.011  -0.599  0.00  0.00    +0.003 A 
ATOM      3  C   LIG    1       -1.944   0.183   0.002  0.00  0.00    -0.004 A 
ATOM      4  C   LIG    1       -1.623   0.394   1.372  0.00  0.00    +0.044 A 
ATOM      5  C   LIG    1       -2.279   1.363   2.139  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -3.233   2.177   1.550  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -1.335  -0.817  -0.793  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -1.633  -0.960  -2.144  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -3.543   2.010   0.200  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1       -2.580  -0.132  -2.731  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   4  11
ATOM     11  C   LIG    1       -0.563  -0.365   2.081  0.00  0.00    +0.245 C 
ATOM     12  N   LIG    1        0.687  -0.299   1.511  0.00  0.00    -0.307 N 
ATOM     13  H   LIG    1        0.844   0.340   0.742  0.00  0.00    +0.149 HD
ATOM     14  O   LIG    1       -0.810  -0.940   3.134  0.00  0.00    -0.270 OA
BRANCH  12  15
ATOM     15  C   LIG    1        1.835  -0.870   2.172  0.00  0.00    +0.139 C 
BRANCH  15  16
ATOM     16  C   LIG    1        3.015  -0.911   1.239  0.00  0.00    -0.030 A 
ATOM     17  C   LIG    1        3.163  -1.970   0.332  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1        4.239  -1.996  -0.556  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        5.173  -0.962  -0.550  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        5.031   0.101   0.340  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.955   0.129   1.229  0.00  0.00    +0.005 A 
ENDBRANCH  15  16
ENDBRANCH  12  15
ENDBRANCH   4  11
BRANCH   1  22
ATOM     22  N   LIG    1       -4.187   1.654  -2.645  0.00  0.00    -0.357 N 
ATOM     23  H   LIG    1       -4.545   1.249  -3.505  0.00  0.00    +0.142 HD
ATOM     24  H   LIG    1       -4.944   1.987  -2.058  0.00  0.00    +0.142 HD
ENDBRANCH   1  22
TORSDOF 4