REMARK  Name = BDB014142
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.135  -1.176   0.125  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1       -0.925  -2.206   0.984  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1       -1.996  -2.676   1.655  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1       -3.273  -2.162   1.520  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1       -3.477  -1.092   0.646  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.386  -0.600  -0.072  0.00  0.00    +0.040 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1       -4.813  -0.550   0.496  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1       -5.192   0.755   0.279  0.00  0.00    +0.166 A 
ATOM      9  N   LIG    1       -6.554   0.699   0.241  0.00  0.00    -0.253 N 
ATOM     10  H   LIG    1       -7.229   1.446   0.107  0.00  0.00    +0.191 HD
ATOM     11  N   LIG    1       -7.002  -0.547   0.444  0.00  0.00    -0.067 NA
ATOM     12  N   LIG    1       -5.942  -1.325   0.609  0.00  0.00    -0.129 NA
BRANCH   8  13
ATOM     13  C   LIG    1       -4.497   2.028   0.131  0.00  0.00    +0.436 C 
ATOM     14  F   LIG    1       -3.513   2.195   1.044  0.00  0.00    -0.164 F 
ATOM     15  F   LIG    1       -3.943   2.160  -1.097  0.00  0.00    -0.164 F 
ATOM     16  F   LIG    1       -5.354   3.072   0.281  0.00  0.00    -0.164 F 
ENDBRANCH   8  13
ENDBRANCH   5   7
BRANCH   1  19
ATOM     17  N   LIG    1        2.051  -0.396  -1.359  0.00  0.00    -0.332 N 
ATOM     18  C   LIG    1        1.310  -1.159  -0.501  0.00  0.00    +0.117 A 
ATOM     19  C   LIG    1        0.021  -0.680  -0.610  0.00  0.00    +0.107 A 
ATOM     20  N   LIG    1       -0.028   0.350  -1.531  0.00  0.00    -0.234 NA
ATOM     21  C   LIG    1        1.205   0.489  -1.964  0.00  0.00    +0.200 A 
BRANCH  17  22
ATOM     22  C   LIG    1        3.471  -0.532  -1.623  0.00  0.00    +0.160 C 
BRANCH  22  28
ATOM     23  F   LIG    1        6.506   2.103   2.326  0.00  0.00    -0.205 F 
ATOM     24  C   LIG    1        5.787   1.478   1.385  0.00  0.00    +0.126 A 
ATOM     25  C   LIG    1        5.587   0.109   1.475  0.00  0.00    +0.077 A 
ATOM     26  C   LIG    1        4.840  -0.525   0.490  0.00  0.00    +0.131 A 
ATOM     27  F   LIG    1        4.649  -1.849   0.578  0.00  0.00    -0.205 F 
ATOM     28  C   LIG    1        4.292   0.184  -0.586  0.00  0.00    +0.008 A 
ATOM     29  C   LIG    1        4.504   1.570  -0.655  0.00  0.00    +0.011 A 
ATOM     30  C   LIG    1        5.254   2.215   0.331  0.00  0.00    +0.039 A 
ENDBRANCH  22  28
ENDBRANCH  17  22
ENDBRANCH   1  19
TORSDOF 5