REMARK  Name = BDB015233
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.461   0.148   0.444  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        2.615   0.212  -0.669  0.00  0.00    +0.058 A 
ATOM      3  C   LIG    1        1.385  -0.443  -0.650  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        1.011  -1.186   0.470  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        1.843  -1.233   1.592  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        3.065  -0.561   1.585  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        4.819   1.940  -0.187  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        4.766   0.860   0.386  0.00  0.00    +0.248 C 
ATOM      9  N   LIG    1        5.821   0.187   0.975  0.00  0.00    -0.280 N 
ATOM     10  H   LIG    1        5.645  -0.753   1.303  0.00  0.00    +0.155 HD
BRANCH   9  11
ATOM     11  C   LIG    1        7.153   0.640   1.078  0.00  0.00    +0.052 A 
ATOM     12  C   LIG    1        7.612   1.887   0.665  0.00  0.00    +0.134 A 
ATOM     13  N   LIG    1        8.902   2.300   0.780  0.00  0.00    -0.261 NA
ATOM     14  C   LIG    1        9.774   1.432   1.330  0.00  0.00    +0.111 A 
ATOM     15  C   LIG    1        9.420   0.172   1.776  0.00  0.00    +0.021 A 
ATOM     16  C   LIG    1        8.090  -0.226   1.648  0.00  0.00    +0.026 A 
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  O   LIG    1        0.648  -0.373  -1.798  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -0.761  -0.144  -1.627  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.550  -1.301  -2.251  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -1.618  -2.401  -1.324  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -2.417  -2.221  -0.788  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.999  -0.926  -2.643  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.868  -0.792  -1.449  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -4.048   0.630  -1.079  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -5.019   0.837   0.064  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -6.000  -0.127   0.356  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -6.912   0.099   1.398  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -6.864   1.284   2.131  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.905   2.249   1.832  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -6.026  -1.429  -0.403  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -4.989   2.030   0.801  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -5.200  -1.380  -1.698  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 8