REMARK  Name = BDB054897
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.682  -0.152   0.816  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        1.083   0.388  -0.328  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1       -0.287   0.225  -0.569  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -1.082  -0.483   0.330  0.00  0.00    +0.035 A 
ATOM      5  C   LIG    1       -0.486  -1.016   1.477  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1        0.885  -0.855   1.718  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1       -2.466  -0.682   0.165  0.00  0.00    -0.269 N 
ATOM      8  H   LIG    1       -2.930  -1.234   0.870  0.00  0.00    +0.156 HD
ATOM      9  C   LIG    1       -3.229  -0.391  -0.945  0.00  0.00    +0.304 C 
ATOM     10  N   LIG    1       -4.567  -0.631  -0.686  0.00  0.00    -0.296 N 
ATOM     11  H   LIG    1       -4.843  -0.483   0.273  0.00  0.00    +0.151 HD
ATOM     12  O   LIG    1       -2.827   0.010  -2.028  0.00  0.00    -0.253 OA
BRANCH  10  13
ATOM     13  C   LIG    1       -5.571  -0.343  -1.701  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -6.911  -0.982  -1.351  0.00  0.00    +0.022 C 
ATOM     15  C   LIG    1       -7.577  -0.004  -0.385  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1       -6.912   1.352  -0.622  0.00  0.00    +0.002 C 
ATOM     17  C   LIG    1       -5.920   1.143  -1.763  0.00  0.00    +0.022 C 
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  19
ATOM     18  C   LIG    1        3.879  -0.373   2.002  0.00  0.00    +0.250 C 
ATOM     19  N   LIG    1        3.068   0.049   0.969  0.00  0.00    -0.281 N 
ATOM     20  H   LIG    1        3.518   0.583   0.231  0.00  0.00    +0.155 HD
ATOM     21  O   LIG    1        3.503  -0.970   3.004  0.00  0.00    -0.270 OA
BRANCH  18  29
ATOM     22  C   LIG    1        5.832   0.011  -0.700  0.00  0.00    +0.144 A 
ATOM     23  C   LIG    1        6.061   0.153   0.704  0.00  0.00    +0.117 A 
ATOM     24  N   LIG    1        7.318   0.541   1.077  0.00  0.00    -0.234 N 
ATOM     25  C   LIG    1        7.412   0.560   2.439  0.00  0.00    +0.114 A 
ATOM     26  C   LIG    1        6.186   0.206   2.951  0.00  0.00    +0.035 A 
ATOM     27  N   LIG    1        8.310   0.855   0.231  0.00  0.00    -0.155 NA
ATOM     28  C   LIG    1        7.992   0.739  -1.018  0.00  0.00    +0.245 A 
ATOM     29  C   LIG    1        5.293  -0.014   1.853  0.00  0.00    +0.067 A 
ATOM     30  N   LIG    1        6.788   0.315  -1.524  0.00  0.00    -0.217 NA
BRANCH  22  31
ATOM     31  N   LIG    1        4.665  -0.436  -1.251  0.00  0.00    -0.341 N 
ATOM     32  H   LIG    1        4.231  -1.212  -0.756  0.00  0.00    +0.144 HD
ATOM     33  H   LIG    1        4.794  -0.665  -2.234  0.00  0.00    +0.144 HD
ENDBRANCH  22  31
ENDBRANCH  18  29
ENDBRANCH   1  19
TORSDOF 5