REMARK  Name = BDB036865
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.557   1.192   0.527  0.00  0.00    +0.265 C 
ATOM      2  N   LIG    1        0.916  -0.161   0.463  0.00  0.00    -0.288 N 
ATOM      3  C   LIG    1        0.153  -1.232   1.106  0.00  0.00    +0.133 C 
ATOM      4  O   LIG    1        1.346   2.077   0.201  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.279  -0.468  -0.001  0.00  0.00    +0.163 C 
ATOM      6  C   LIG    1        3.273  -0.560   1.172  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1        3.026  -0.207   2.323  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1        4.506  -1.086   0.856  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1        5.149  -1.156   1.633  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1        4.783  -1.921  -0.198  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1        5.798  -2.609  -0.210  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        3.791  -1.924  -1.337  0.00  0.00    +0.098 C 
ATOM     13  C   LIG    1        2.367  -1.751  -0.828  0.00  0.00    +0.041 C 
ENDBRANCH   2   5
BRANCH   1  18
ATOM     14  C   LIG    1       -3.387   2.721   3.242  0.00  0.00    +0.067 C 
ATOM     15  C   LIG    1       -2.505   2.166   2.189  0.00  0.00    +0.061 A 
ATOM     16  N   LIG    1       -3.024   1.472   1.174  0.00  0.00    -0.171 NA
ATOM     17  N   LIG    1       -1.969   1.191   0.354  0.00  0.00    -0.227 N 
ATOM     18  C   LIG    1       -0.770   1.515   0.971  0.00  0.00    +0.129 A 
ATOM     19  C   LIG    1       -1.106   2.236   2.102  0.00  0.00    +0.057 A 
BRANCH  17  20
ATOM     20  C   LIG    1       -2.219   0.625  -0.934  0.00  0.00    +0.066 A 
ATOM     21  C   LIG    1       -1.247   0.607  -1.943  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1       -1.533   0.036  -3.187  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -2.789  -0.511  -3.439  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -3.770  -0.477  -2.452  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -3.491   0.094  -1.208  0.00  0.00    +0.028 A 
ENDBRANCH  17  20
ENDBRANCH   1  18
TORSDOF 3