REMARK  Name = BDB027877
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.871   0.203   1.188  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        2.535   0.101   2.424  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        3.929   0.104   2.362  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        4.594   0.014   3.576  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        4.015  -0.084   4.802  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        2.672  -0.103   4.824  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        4.611   0.185   1.211  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        3.892   0.252   0.081  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        1.898  -0.015   3.682  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        2.550   0.262   0.034  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.625   0.324  -1.197  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.954   0.386  -2.428  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.686   0.454  -3.603  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        6.032   0.465  -3.648  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        6.674   0.405  -2.464  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        6.028   0.335  -1.240  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        0.469   0.227   1.174  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1        0.161   0.969   1.798  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -0.346   0.216  -0.066  0.00  0.00    +0.029 C 
ATOM     20  C   LIG    1       -0.125   1.508  -0.872  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -0.048  -1.032  -0.913  0.00  0.00    +0.031 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -1.828   0.157   0.440  0.00  0.00    +0.040 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.913   0.030  -0.643  0.00  0.00    +0.086 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.288   0.198  -0.128  0.00  0.00    -0.303 NA
BRANCH  24  26
ATOM     25  C   LIG    1       -4.676  -2.244   0.495  0.00  0.00    +0.020 C 
ATOM     26  C   LIG    1       -4.665  -0.776   0.911  0.00  0.00    +0.081 C 
ENDBRANCH  24  26
BRANCH  24  27
ATOM     27  C   LIG    1       -5.238   0.260  -1.254  0.00  0.00    +0.081 C 
ATOM     28  C   LIG    1       -6.660   0.636  -0.850  0.00  0.00    +0.020 C 
ENDBRANCH  24  27
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 8