REMARK  Name = BDB052606
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.906  -1.056  -0.115  0.00  0.00    +0.134 A 
ATOM      2  C   LIG    1        0.525  -1.235  -0.295  0.00  0.00    +0.088 A 
ATOM      3  C   LIG    1        0.135  -2.354  -1.014  0.00  0.00    +0.233 A 
ATOM      4  O   LIG    1       -1.218  -2.389  -1.130  0.00  0.00    -0.436 OA
ATOM      5  C   LIG    1       -1.727  -1.301  -0.476  0.00  0.00    +0.146 A 
ATOM      6  N   LIG    1        0.925  -3.294  -1.547  0.00  0.00    -0.200 NA
ATOM      7  C   LIG    1        2.213  -3.034  -1.314  0.00  0.00    +0.227 A 
ATOM      8  C   LIG    1       -0.684  -0.556   0.059  0.00  0.00    +0.041 A 
ATOM      9  N   LIG    1        2.738  -1.981  -0.654  0.00  0.00    -0.220 NA
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1       -3.187  -1.210  -0.495  0.00  0.00    +0.018 A 
ATOM     11  C   LIG    1       -3.900  -0.675   0.587  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1       -5.295  -0.588   0.553  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -5.997  -1.039  -0.562  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -5.305  -1.581  -1.642  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -3.911  -1.668  -1.607  0.00  0.00    +0.011 A 
ENDBRANCH   5  10
BRANCH   8  16
ATOM     16  C   LIG    1       -0.851   0.681   0.796  0.00  0.00    -0.014 A 
ATOM     17  C   LIG    1       -1.366   1.819   0.164  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1       -1.508   3.011   0.876  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -1.133   3.073   2.218  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -0.616   1.943   2.851  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1       -0.474   0.749   2.143  0.00  0.00    +0.008 A 
ENDBRANCH   8  16
BRANCH   1  22
ATOM     22  N   LIG    1        2.436   0.022   0.574  0.00  0.00    -0.326 N 
ATOM     23  H   LIG    1        1.824   0.830   0.627  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  C   LIG    1        3.869   0.306   0.556  0.00  0.00    +0.134 C 
BRANCH  24  26
ATOM     25  C   LIG    1        5.638   1.670  -0.632  0.00  0.00    +0.039 C 
ATOM     26  C   LIG    1        4.327   0.911  -0.789  0.00  0.00    +0.128 C 
BRANCH  26  27
ATOM     27  O   LIG    1        4.546  -0.106  -1.771  0.00  0.00    -0.391 OA
ATOM     28  H   LIG    1        3.921  -0.831  -1.562  0.00  0.00    +0.210 HD
ENDBRANCH  26  27
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH   1  22
TORSDOF 6