REMARK  Name = BDB002471
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -6.179  -1.293  -0.203  0.00  0.00    +0.157 C 
ATOM      2  N   LIG    1       -4.800  -1.557  -0.566  0.00  0.00    -0.262 N 
ATOM      3  C   LIG    1       -4.439  -2.907  -0.737  0.00  0.00    +0.333 A 
ATOM      4  O   LIG    1       -5.257  -3.815  -0.562  0.00  0.00    -0.246 OA
ATOM      5  N   LIG    1       -3.120  -3.171  -1.104  0.00  0.00    -0.280 N 
ATOM      6  C   LIG    1       -2.682  -4.539  -1.300  0.00  0.00    +0.155 C 
ATOM      7  C   LIG    1       -2.227  -2.131  -1.196  0.00  0.00    +0.168 A 
ATOM      8  N   LIG    1       -0.912  -2.242  -1.512  0.00  0.00    -0.213 NA
ATOM      9  C   LIG    1       -0.444  -1.002  -1.491  0.00  0.00    +0.127 A 
ATOM     10  N   LIG    1       -1.446  -0.104  -1.149  0.00  0.00    -0.317 N 
ATOM     11  C   LIG    1       -2.593  -0.840  -0.972  0.00  0.00    +0.152 A 
ATOM     12  C   LIG    1       -3.923  -0.469  -0.623  0.00  0.00    +0.282 A 
ATOM     13  O   LIG    1       -4.257   0.687  -0.382  0.00  0.00    -0.265 OA
ENDROOT
BRANCH  10  14
ATOM     14  C   LIG    1       -1.331   1.351  -1.097  0.00  0.00    +0.161 C 
BRANCH  14  15
ATOM     15  C   LIG    1       -0.790   1.868   0.209  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1        0.264   2.789   0.197  0.00  0.00    +0.128 A 
ATOM     17  F   LIG    1        0.771   3.206  -0.973  0.00  0.00    -0.205 F 
ATOM     18  C   LIG    1        0.809   3.293   1.375  0.00  0.00    +0.039 A 
ATOM     19  C   LIG    1        0.282   2.898   2.601  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1       -0.790   2.006   2.639  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -1.325   1.496   1.451  0.00  0.00    +0.008 A 
ENDBRANCH  14  15
ENDBRANCH  10  14
BRANCH   9  22
ATOM     22  C   LIG    1        0.978  -0.618  -1.796  0.00  0.00    +0.159 C 
BRANCH  22  23
ATOM     23  N   LIG    1        1.684  -0.116  -0.613  0.00  0.00    -0.291 NA
ATOM     24  C   LIG    1        2.952   0.523  -1.006  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        3.768   1.001   0.175  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        3.583   0.438   1.450  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        4.355   0.888   2.529  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        5.323   1.873   2.339  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.522   2.420   1.074  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        2.504  -0.592   1.671  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        4.753   1.983  -0.005  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        1.958  -1.183   0.363  0.00  0.00    +0.090 C 
ENDBRANCH  22  23
ENDBRANCH   9  22
TORSDOF 4