REMARK  Name = BDB060610
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.585  -0.200   1.136  0.00  0.00    +0.166 C 
ATOM      2  C   LIG    1        1.450   0.635   2.075  0.00  0.00    +0.177 C 
ATOM      3  C   LIG    1        2.806   0.615   1.397  0.00  0.00    +0.195 C 
ATOM      4  C   LIG    1        2.844  -0.813   0.844  0.00  0.00    +0.253 C 
ATOM      5  O   LIG    1        1.484  -1.167   0.518  0.00  0.00    -0.347 OA
ENDROOT
BRANCH   4   6
ATOM      6  N   LIG    1        3.673  -0.948  -0.340  0.00  0.00    -0.286 N 
ATOM      7  C   LIG    1        4.995  -0.596  -0.423  0.00  0.00    +0.167 A 
ATOM      8  C   LIG    1        5.370  -0.915  -1.718  0.00  0.00    +0.147 A 
ATOM      9  C   LIG    1        6.701  -0.644  -2.074  0.00  0.00    +0.147 A 
ATOM     10  N   LIG    1        7.525  -0.121  -1.137  0.00  0.00    -0.219 NA
ATOM     11  C   LIG    1        7.021   0.144   0.086  0.00  0.00    +0.225 A 
ATOM     12  N   LIG    1        4.312  -1.464  -2.411  0.00  0.00    -0.231 NA
ATOM     13  N   LIG    1        5.762  -0.051   0.539  0.00  0.00    -0.216 NA
ATOM     14  C   LIG    1        3.313  -1.475  -1.552  0.00  0.00    +0.203 A 
BRANCH   9  15
ATOM     15  N   LIG    1        7.219  -0.904  -3.335  0.00  0.00    -0.341 N 
ATOM     16  H   LIG    1        6.679  -1.580  -3.864  0.00  0.00    +0.144 HD
ATOM     17  H   LIG    1        8.225  -1.008  -3.326  0.00  0.00    +0.144 HD
ENDBRANCH   9  15
ENDBRANCH   4   6
BRANCH   2  18
ATOM     18  O   LIG    1        1.561  -0.023   3.348  0.00  0.00    -0.386 OA
ATOM     19  H   LIG    1        2.386   0.329   3.747  0.00  0.00    +0.210 HD
ENDBRANCH   2  18
BRANCH   3  20
ATOM     20  O   LIG    1        3.830   0.910   2.349  0.00  0.00    -0.385 OA
ATOM     21  H   LIG    1        4.687   0.741   1.898  0.00  0.00    +0.210 HD
ENDBRANCH   3  20
BRANCH   1  22
ATOM     22  C   LIG    1       -0.096   0.587  -0.014  0.00  0.00    +0.119 C 
BRANCH  22  29
ATOM     23  C   LIG    1       -6.907  -1.022  -2.175  0.00  0.00    +0.109 C 
ATOM     24  C   LIG    1       -5.458  -1.436  -2.224  0.00  0.00    +0.212 C 
ATOM     25  N   LIG    1       -4.589  -0.797  -1.351  0.00  0.00    -0.302 N 
ATOM     26  C   LIG    1       -3.190  -1.219  -1.319  0.00  0.00    +0.109 C 
ATOM     27  C   LIG    1       -2.606  -1.034   0.075  0.00  0.00    +0.041 C 
ATOM     28  C   LIG    1       -2.585   0.454   0.510  0.00  0.00    +0.025 C 
ATOM     29  N   LIG    1       -1.381   1.263   0.188  0.00  0.00    -0.294 NA
ATOM     30  C   LIG    1       -1.355   2.382   1.130  0.00  0.00    +0.085 C 
ATOM     31  C   LIG    1       -1.973   1.865   2.417  0.00  0.00    +0.017 C 
ATOM     32  C   LIG    1       -2.664   0.558   2.046  0.00  0.00    +0.024 C 
ATOM     33  C   LIG    1       -3.791   1.205  -0.143  0.00  0.00    +0.041 C 
ATOM     34  C   LIG    1       -4.971   0.287  -0.448  0.00  0.00    +0.109 C 
ATOM     35  O   LIG    1       -5.088  -2.303  -3.016  0.00  0.00    -0.276 OA
ENDBRANCH  22  29
ENDBRANCH   1  22
TORSDOF 6