REMARK  Name = BDB027965
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.657   0.516   0.376  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1        0.663   0.039   0.230  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        1.738   0.822  -0.246  0.00  0.00    +0.032 A 
ATOM      4  C   LIG    1        1.441   2.146  -0.587  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1        0.154   2.662  -0.447  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -0.877   1.856   0.032  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   3   7
ATOM      7  N   LIG    1        3.015   0.295  -0.382  0.00  0.00    -0.327 N 
ATOM      8  C   LIG    1        3.457  -0.838   0.449  0.00  0.00    +0.120 C 
ATOM      9  C   LIG    1        4.984  -0.800   0.691  0.00  0.00    +0.100 C 
ATOM     10  N   LIG    1        5.820  -0.761  -0.522  0.00  0.00    -0.313 NA
ATOM     11  H   LIG    1        6.003  -1.713  -0.837  0.00  0.00    +0.122 HD
ATOM     12  C   LIG    1        5.140  -0.041  -1.616  0.00  0.00    +0.100 C 
ATOM     13  C   LIG    1        4.054   0.969  -1.177  0.00  0.00    +0.120 C 
ENDBRANCH   3   7
BRANCH   1  15
ATOM     14  C   LIG    1       -1.373  -1.508   1.596  0.00  0.00    +0.130 C 
ATOM     15  N   LIG    1       -1.694  -0.284   0.864  0.00  0.00    -0.321 N 
BRANCH  15  16
ATOM     16  C   LIG    1       -3.047  -0.142   0.277  0.00  0.00    +0.160 C 
ATOM     17  C   LIG    1       -3.634  -1.466  -0.264  0.00  0.00    +0.240 C 
ATOM     18  O   LIG    1       -2.970  -2.386  -0.740  0.00  0.00    -0.273 OA
ATOM     19  N   LIG    1       -5.008  -1.571  -0.244  0.00  0.00    -0.255 N 
ATOM     20  H   LIG    1       -5.387  -2.429  -0.620  0.00  0.00    +0.158 HD
ATOM     21  C   LIG    1       -5.924  -0.658   0.215  0.00  0.00    +0.219 C 
ATOM     22  O   LIG    1       -7.129  -0.875   0.136  0.00  0.00    -0.275 OA
ATOM     23  C   LIG    1       -5.371   0.639   0.751  0.00  0.00    +0.098 C 
ATOM     24  C   LIG    1       -3.985   0.442   1.338  0.00  0.00    +0.041 C 
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 3