REMARK  Name = BDB033519
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.484   1.558   1.928  0.00  0.00    +0.029 A 
ATOM      2  C   LIG    1        1.643   1.115   1.260  0.00  0.00    +0.049 A 
ATOM      3  C   LIG    1        2.922   1.430   1.726  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1        3.033   2.233   2.864  0.00  0.00    +0.145 A 
ATOM      5  F   LIG    1        4.251   2.556   3.330  0.00  0.00    -0.204 F 
ATOM      6  C   LIG    1        1.911   2.717   3.523  0.00  0.00    +0.042 A 
ATOM      7  C   LIG    1        0.641   2.388   3.046  0.00  0.00    +0.026 A 
ENDROOT
BRANCH   3   8
ATOM      8  N   LIG    1        4.126   1.003   1.123  0.00  0.00    -0.283 N 
ATOM      9  H   LIG    1        4.969   1.341   1.576  0.00  0.00    +0.155 HD
ATOM     10  C   LIG    1        4.277   0.175   0.025  0.00  0.00    +0.218 C 
ATOM     11  O   LIG    1        3.375  -0.355  -0.613  0.00  0.00    -0.275 OA
BRANCH  10  12
ATOM     12  C   LIG    1        5.740  -0.028  -0.321  0.00  0.00    +0.101 C 
BRANCH  12  13
ATOM     13  C   LIG    1        5.916  -0.934  -1.536  0.00  0.00    +0.047 C 
BRANCH  13  14
ATOM     14  C   LIG    1        7.354  -1.130  -1.881  0.00  0.00    -0.009 A 
ATOM     15  C   LIG    1        8.197  -2.121  -1.420  0.00  0.00    +0.198 A 
ATOM     16  O   LIG    1        9.440  -1.981  -1.944  0.00  0.00    -0.471 OA
ATOM     17  C   LIG    1        9.404  -0.897  -2.760  0.00  0.00    +0.195 A 
ATOM     18  C   LIG    1        8.148  -0.338  -2.758  0.00  0.00    +0.044 A 
ENDBRANCH  13  14
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   3   8
BRANCH   1  19
ATOM     19  N   LIG    1       -0.761   1.260   1.364  0.00  0.00    -0.340 N 
ATOM     20  H   LIG    1       -0.730   0.426   0.780  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -1.962   1.314   2.185  0.00  0.00    +0.136 C 
BRANCH  21  25
ATOM     22  C   LIG    1       -5.301  -0.242  -0.107  0.00  0.00    -0.015 A 
ATOM     23  C   LIG    1       -4.746   1.009  -0.407  0.00  0.00    +0.009 A 
ATOM     24  C   LIG    1       -3.672   1.510   0.335  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1       -3.131   0.771   1.396  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -3.675  -0.484   1.690  0.00  0.00    +0.006 A 
ATOM     27  C   LIG    1       -4.751  -0.984   0.947  0.00  0.00    +0.009 A 
BRANCH  22  32
ATOM     28  C   LIG    1       -9.417  -2.665  -1.475  0.00  0.00    +0.172 C 
ATOM     29  N   LIG    1       -8.241  -1.830  -1.471  0.00  0.00    -0.274 N 
ATOM     30  N   LIG    1       -7.905  -1.156  -2.585  0.00  0.00    -0.179 NA
ATOM     31  C   LIG    1       -6.796  -0.502  -2.229  0.00  0.00    +0.142 A 
ATOM     32  C   LIG    1       -6.414  -0.753  -0.889  0.00  0.00    +0.020 A 
ATOM     33  C   LIG    1       -7.384  -1.622  -0.429  0.00  0.00    +0.116 A 
ENDBRANCH  22  32
ENDBRANCH  21  25
ENDBRANCH  19  21
ENDBRANCH   1  19
TORSDOF 8