REMARK  Name = BDB026350
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.561  -0.036   0.411  0.00  0.00    -0.326 N 
ATOM      2  C   LIG    1        2.254  -1.372   0.950  0.00  0.00    +0.120 C 
ATOM      3  C   LIG    1        0.972  -1.346   1.816  0.00  0.00    +0.103 C 
ATOM      4  N   LIG    1       -0.243  -0.822   1.155  0.00  0.00    -0.295 NA
ATOM      5  C   LIG    1        0.108   0.140   0.083  0.00  0.00    +0.103 C 
ATOM      6  C   LIG    1        1.432   0.905   0.317  0.00  0.00    +0.120 C 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        6.499   1.054  -0.414  0.00  0.00    +0.125 A 
ATOM      8  N   LIG    1        6.198  -0.269  -0.350  0.00  0.00    -0.249 NA
ATOM      9  C   LIG    1        4.901  -0.569  -0.079  0.00  0.00    +0.134 A 
ATOM     10  C   LIG    1        3.862   0.349   0.140  0.00  0.00    +0.048 A 
ATOM     11  C   LIG    1        4.246   1.694   0.052  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1        5.566   2.059  -0.224  0.00  0.00    +0.035 A 
BRANCH   7  16
ATOM     13  C   LIG    1       10.127   0.429  -1.264  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        8.758   0.310  -0.847  0.00  0.00    -0.313 N 
ATOM     15  H   LIG    1        8.301  -0.599  -0.824  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.926   1.402  -0.714  0.00  0.00    +0.262 C 
ATOM     17  O   LIG    1        8.292   2.565  -0.836  0.00  0.00    -0.269 OA
ENDBRANCH   7  16
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  C   LIG    1       -1.090  -1.910   0.643  0.00  0.00    +0.119 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.446  -1.431   0.165  0.00  0.00    -0.031 A 
ATOM     20  C   LIG    1       -3.312  -0.762   1.043  0.00  0.00    +0.032 A 
ATOM     21  C   LIG    1       -4.559  -0.327   0.596  0.00  0.00    +0.068 A 
ATOM     22  C   LIG    1       -4.974  -0.551  -0.725  0.00  0.00    +0.088 A 
ATOM     23  N   LIG    1       -6.225  -0.126  -1.206  0.00  0.00    -0.245 NA
ATOM     24  C   LIG    1       -7.012   0.509  -0.386  0.00  0.00    +0.108 A 
ATOM     25  C   LIG    1       -6.650   0.785   1.073  0.00  0.00    +0.271 A 
ATOM     26  O   LIG    1       -7.439   1.355   1.810  0.00  0.00    -0.266 OA
ATOM     27  C   LIG    1       -4.114  -1.221  -1.593  0.00  0.00    +0.030 A 
ATOM     28  N   LIG    1       -5.416   0.344   1.474  0.00  0.00    -0.319 N 
ATOM     29  H   LIG    1       -5.148   0.518   2.432  0.00  0.00    +0.169 HD
ATOM     30  C   LIG    1       -2.860  -1.660  -1.156  0.00  0.00    +0.007 A 
BRANCH  24  31
ATOM     31  C   LIG    1       -8.361   0.979  -0.854  0.00  0.00    +0.094 C 
BRANCH  31  32
ATOM     32  C   LIG    1       -9.433   0.021  -0.388  0.00  0.00    +0.219 C 
ATOM     33  F   LIG    1      -10.630   0.424  -0.895  0.00  0.00    -0.249 F 
ENDBRANCH  31  32
ENDBRANCH  24  31
ENDBRANCH  18  19
ENDBRANCH   4  18
TORSDOF 6