REMARK  Name = BDB000606
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.079  -0.606  -1.049  0.00  0.00    +0.219 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        2.417  -0.945  -0.659  0.00  0.00    -0.248 N 
ATOM      3  C   LIG    1        3.242  -0.169   0.174  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        4.510  -0.736   0.288  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        5.521  -0.179   1.047  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        5.227   1.008   1.720  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        3.950   1.595   1.616  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        4.517  -1.951  -0.525  0.00  0.00    +0.250 C 
ATOM      9  O   LIG    1        5.436  -2.722  -0.677  0.00  0.00    -0.282 OA
ATOM     10  C   LIG    1        2.944   1.007   0.838  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1        3.104  -2.038  -1.155  0.00  0.00    +0.292 C 
ATOM     12  O   LIG    1        2.733  -2.898  -1.924  0.00  0.00    -0.266 OA
ENDBRANCH   1   2
BRANCH   1  13
ATOM     13  N   LIG    1        0.249  -0.672   0.137  0.00  0.00    -0.328 N 
ATOM     14  H   LIG    1        0.436  -1.522   0.661  0.00  0.00    +0.148 HD
BRANCH  13  18
ATOM     15  C   LIG    1       -3.911   0.109   0.008  0.00  0.00    -0.048 A 
ATOM     16  C   LIG    1       -3.334  -0.607   1.059  0.00  0.00    +0.005 A 
ATOM     17  C   LIG    1       -1.959  -0.864   1.069  0.00  0.00    +0.023 A 
ATOM     18  C   LIG    1       -1.126  -0.439   0.024  0.00  0.00    +0.028 A 
ATOM     19  C   LIG    1       -1.707   0.320  -0.997  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1       -3.083   0.581  -1.014  0.00  0.00    +0.005 A 
BRANCH  15  22
ATOM     21  C   LIG    1       -5.709   1.712   0.708  0.00  0.00    +0.009 C 
ATOM     22  C   LIG    1       -5.388   0.405  -0.001  0.00  0.00    +0.032 C 
ENDBRANCH  15  22
ENDBRANCH  13  18
ENDBRANCH   1  13
TORSDOF 4