REMARK  Name = BDB008835
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.601   0.035  -0.841  0.00  0.00    +0.069 A 
ATOM      2  C   LIG    1        2.565  -0.348  -2.186  0.00  0.00    +0.145 A 
ATOM      3  F   LIG    1        3.353   0.277  -3.075  0.00  0.00    -0.204 F 
ATOM      4  C   LIG    1        1.722  -1.360  -2.633  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1        0.889  -2.010  -1.724  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        0.899  -1.645  -0.369  0.00  0.00    -0.040 A 
ATOM      7  C   LIG    1        1.768  -0.627   0.064  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1   9
ATOM      8  C   LIG    1        3.647   1.684   0.740  0.00  0.00    +0.231 C 
ATOM      9  N   LIG    1        3.479   1.073  -0.486  0.00  0.00    -0.282 N 
ATOM     10  H   LIG    1        4.058   1.469  -1.229  0.00  0.00    +0.155 HD
ATOM     11  O   LIG    1        3.048   1.419   1.779  0.00  0.00    -0.274 OA
BRANCH   8  12
ATOM     12  C   LIG    1        4.731   2.772   0.705  0.00  0.00    +0.175 C 
BRANCH  12  13
ATOM     13  N   LIG    1        4.983   3.238  -0.676  0.00  0.00    -0.322 NA
ATOM     14  H   LIG    1        5.763   3.897  -0.651  0.00  0.00    +0.119 HD
ATOM     15  H   LIG    1        4.178   3.791  -0.979  0.00  0.00    +0.119 HD
ENDBRANCH  12  13
ENDBRANCH   8  12
ENDBRANCH   1   9
BRANCH   6  16
ATOM     16  C   LIG    1        0.003  -2.353   0.622  0.00  0.00    +0.092 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.479  -2.241   0.279  0.00  0.00    +0.069 A 
ATOM     18  C   LIG    1       -2.213  -0.966   0.555  0.00  0.00    -0.016 A 
ATOM     19  C   LIG    1       -1.529   0.197   1.219  0.00  0.00    +0.037 C 
ATOM     20  C   LIG    1       -2.503   1.264   1.729  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -3.584   1.556   0.697  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -4.377   0.292   0.361  0.00  0.00    +0.041 C 
ATOM     23  C   LIG    1       -3.506  -0.922   0.186  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -4.145  -2.108  -0.434  0.00  0.00    +0.268 A 
ATOM     25  O   LIG    1       -5.325  -2.107  -0.771  0.00  0.00    -0.266 OA
ATOM     26  N   LIG    1       -3.341  -3.203  -0.600  0.00  0.00    -0.243 N 
ATOM     27  H   LIG    1       -3.759  -4.025  -1.022  0.00  0.00    +0.192 HD
ATOM     28  N   LIG    1       -2.027  -3.288  -0.265  0.00  0.00    -0.175 NA
ENDBRANCH  16  17
ENDBRANCH   6  16
TORSDOF 5