REMARK  Name = BDB015941
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.487   1.331   0.832  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1        0.449   0.481   0.701  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -0.640   0.673   1.471  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -0.718   1.740   2.369  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1        0.404   2.545   2.433  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        1.513   2.365   1.690  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.822  -0.181  -1.782  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.707   0.052  -0.961  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.672   1.104  -0.020  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.810   1.925   0.066  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.928   1.708  -0.742  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.934   0.660  -1.662  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        4.654  -3.005  -5.784  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        4.186  -2.515  -4.510  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        3.359  -3.276  -3.771  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.131  -2.525  -2.690  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        3.809  -1.284  -2.728  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        4.485  -1.315  -3.932  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -1.863   2.027   3.210  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.174   2.074   2.782  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -3.924   2.397   3.875  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.357   2.557   3.928  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -3.191   2.578   4.989  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -1.938   2.363   4.581  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -1.724  -0.208   1.323  0.00  0.00    -0.324 N 
ATOM     26  H   LIG    1       -2.067  -0.486   2.240  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.580  -1.330   0.385  0.00  0.00    +0.089 C 
ATOM     28  C   LIG    1       -2.578  -2.447   0.745  0.00  0.00    +0.126 C 
ATOM     29  N   LIG    1       -3.960  -2.054   0.556  0.00  0.00    -0.314 N 
ATOM     30  H   LIG    1       -4.693  -2.650   0.922  0.00  0.00    +0.149 HD
ATOM     31  C   LIG    1       -4.377  -1.251  -0.468  0.00  0.00    +0.213 C 
ATOM     32  O   LIG    1       -5.570  -1.205  -0.760  0.00  0.00    -0.276 OA
ATOM     33  C   LIG    1       -3.348  -0.366  -1.142  0.00  0.00    +0.097 C 
ATOM     34  C   LIG    1       -1.913  -0.874  -1.040  0.00  0.00    +0.033 C 
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 5