REMARK  Name = BDB053407
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.182  -1.110  -1.679  0.00  0.00    +0.121 C 
ATOM      2  C   LIG    1       -0.805  -0.250  -0.608  0.00  0.00    -0.021 A 
ATOM      3  C   LIG    1       -2.072  -0.740  -0.270  0.00  0.00    -0.042 A 
ATOM      4  C   LIG    1       -2.865  -0.094   0.667  0.00  0.00    +0.012 A 
ATOM      5  C   LIG    1       -2.380   1.070   1.287  0.00  0.00    -0.017 A 
ATOM      6  C   LIG    1       -1.096   1.548   0.944  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1       -2.410  -1.962  -1.068  0.00  0.00    +0.038 C 
ATOM      8  C   LIG    1       -0.310   0.900  -0.013  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -1.031  -2.397  -1.585  0.00  0.00    +0.034 C 
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1        2.220  -0.910  -2.448  0.00  0.00    +0.112 A 
ATOM     11  N   LIG    1        1.248  -1.297  -1.538  0.00  0.00    -0.305 N 
ATOM     12  C   LIG    1        1.890  -1.880  -0.473  0.00  0.00    +0.161 A 
ATOM     13  C   LIG    1        3.237  -1.846  -0.799  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        4.161  -2.380   0.113  0.00  0.00    -0.020 A 
ATOM     15  C   LIG    1        3.619  -2.889   1.306  0.00  0.00    +0.028 A 
ATOM     16  C   LIG    1        2.238  -2.869   1.524  0.00  0.00    +0.041 A 
ATOM     17  C   LIG    1        1.692  -3.423   2.810  0.00  0.00    +0.065 C 
ATOM     18  C   LIG    1        5.641  -2.374  -0.113  0.00  0.00    +0.046 C 
ATOM     19  N   LIG    1        1.332  -2.373   0.649  0.00  0.00    -0.233 NA
ATOM     20  N   LIG    1        3.423  -1.257  -2.023  0.00  0.00    -0.230 NA
BRANCH  10  21
ATOM     21  C   LIG    1        1.922  -0.207  -3.739  0.00  0.00    +0.074 C 
BRANCH  21  23
ATOM     22  C   LIG    1        3.752   1.562  -3.729  0.00  0.00    +0.004 C 
ATOM     23  C   LIG    1        3.162   0.351  -4.441  0.00  0.00    +0.004 C 
ENDBRANCH  21  23
ENDBRANCH  10  21
ENDBRANCH   1  11
BRANCH   5  24
ATOM     24  C   LIG    1       -3.205   1.790   2.270  0.00  0.00    -0.007 A 
ATOM     25  C   LIG    1       -3.789   3.059   2.023  0.00  0.00    +0.028 A 
ATOM     26  C   LIG    1       -4.513   3.683   3.058  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1       -4.683   3.071   4.301  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -4.128   1.821   4.537  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -3.394   1.191   3.534  0.00  0.00    +0.009 A 
BRANCH  25  30
ATOM     30  C   LIG    1       -3.689   3.783   0.750  0.00  0.00    +0.180 A 
ATOM     31  N   LIG    1       -3.516   3.228  -0.489  0.00  0.00    -0.239 N 
ATOM     32  H   LIG    1       -3.416   2.257  -0.756  0.00  0.00    +0.192 HD
ATOM     33  N   LIG    1       -3.476   4.177  -1.433  0.00  0.00    -0.046 NA
ATOM     34  N   LIG    1       -3.637   5.316  -0.779  0.00  0.00    -0.023 NA
ATOM     35  N   LIG    1       -3.796   5.089   0.566  0.00  0.00    -0.108 NA
ENDBRANCH  25  30
ENDBRANCH   5  24
TORSDOF 5