REMARK  Name = BDB023662
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.245  -1.706   1.097  0.00  0.00    -0.017 A 
ATOM      2  C   LIG    1       -1.761  -0.640   0.340  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1       -3.134  -0.536   0.076  0.00  0.00    -0.025 A 
ATOM      4  C   LIG    1       -3.677   0.562  -0.800  0.00  0.00    +0.054 C 
ATOM      5  C   LIG    1       -5.130   0.905  -0.432  0.00  0.00    +0.069 C 
ATOM      6  C   LIG    1       -5.735   1.903  -1.423  0.00  0.00    +0.132 C 
ATOM      7  N   LIG    1       -5.278   3.240  -0.940  0.00  0.00    -0.268 N 
ATOM      8  C   LIG    1       -4.917   3.128   0.497  0.00  0.00    +0.117 C 
ATOM      9  C   LIG    1       -5.960  -0.369  -0.349  0.00  0.00    +0.225 C 
ATOM     10  N   LIG    1       -5.367  -1.436   0.275  0.00  0.00    -0.285 N 
ATOM     11  H   LIG    1       -5.966  -2.233   0.454  0.00  0.00    +0.155 HD
ATOM     12  O   LIG    1       -7.129  -0.441  -0.719  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -5.238   1.690   0.884  0.00  0.00    +0.037 C 
ATOM     14  C   LIG    1       -4.001  -1.518   0.561  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1       -3.512  -2.593   1.295  0.00  0.00    +0.024 A 
ATOM     16  C   LIG    1       -2.143  -2.680   1.567  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  19
ATOM     17  C   LIG    1        2.509  -1.864   0.613  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1        1.139  -1.774   0.338  0.00  0.00    +0.021 A 
ATOM     19  C   LIG    1        0.197  -1.809   1.377  0.00  0.00    -0.017 A 
ATOM     20  C   LIG    1        0.669  -1.952   2.695  0.00  0.00    +0.008 A 
ATOM     21  C   LIG    1        2.036  -2.068   2.968  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        2.959  -2.033   1.926  0.00  0.00    +0.013 A 
BRANCH  17  28
ATOM     23  C   LIG    1        6.331   1.976  -1.732  0.00  0.00    +0.105 C 
ATOM     24  N   LIG    1        6.746   0.988  -0.738  0.00  0.00    -0.302 NA
ATOM     25  C   LIG    1        5.843   0.968   0.429  0.00  0.00    +0.103 C 
ATOM     26  C   LIG    1        4.460   0.338   0.175  0.00  0.00    +0.123 C 
ATOM     27  N   LIG    1        4.550  -0.977  -0.475  0.00  0.00    -0.295 N 
ATOM     28  C   LIG    1        3.466  -1.858  -0.515  0.00  0.00    +0.247 C 
ATOM     29  O   LIG    1        3.269  -2.650  -1.433  0.00  0.00    -0.270 OA
ATOM     30  C   LIG    1        5.468  -1.031  -1.615  0.00  0.00    +0.123 C 
ATOM     31  C   LIG    1        6.826  -0.369  -1.316  0.00  0.00    +0.103 C 
ENDBRANCH  17  28
ENDBRANCH   1  19
BRANCH   7  32
ATOM     32  C   LIG    1       -5.552   4.396  -1.559  0.00  0.00    +0.169 C 
ATOM     33  N   LIG    1       -5.784   5.397  -2.090  0.00  0.00    -0.174 NA
ENDBRANCH   7  32
TORSDOF 3