REMARK  Name = BDB008063
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.827  -0.101  -0.666  0.00  0.00    +0.195 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.542   1.217   0.026  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1       -0.402   2.457  -0.708  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -0.016   3.445   0.191  0.00  0.00    +0.049 A 
ATOM      5  C   LIG    1        0.237   4.770  -0.186  0.00  0.00    +0.046 A 
ATOM      6  C   LIG    1        0.089   5.093  -1.536  0.00  0.00    +0.043 A 
ATOM      7  C   LIG    1       -0.289   4.134  -2.470  0.00  0.00    +0.021 A 
ATOM      8 CL   LIG    1        0.388   6.708  -2.055  0.00  0.00    -0.083 Cl
ATOM      9  N   LIG    1        0.080   2.849   1.418  0.00  0.00    -0.349 N 
ATOM     10  H   LIG    1        0.391   3.314   2.263  0.00  0.00    +0.166 HD
ATOM     11  C   LIG    1       -0.532   2.813  -2.070  0.00  0.00    +0.012 A 
ATOM     12  CA  LIG    1       -0.290   1.521   1.370  0.00  0.00    +0.131 A 
BRANCH  12  13
ATOM     13  C   LIG    1       -0.233   0.753   2.592  0.00  0.00    +0.354 C 
ATOM     14  O   LIG    1        0.663   0.848   3.417  0.00  0.00    -0.243 OA
BRANCH  13  15
ATOM     15  OXT LIG    1       -1.308  -0.029   2.797  0.00  0.00    -0.476 OA
ATOM     16  HXT LIG    1       -2.035   0.063   2.137  0.00  0.00    +0.295 HD
ENDBRANCH  13  15
ENDBRANCH  12  13
ENDBRANCH   1   2
BRANCH   1  19
ATOM     17  N   LIG    1       -1.537  -2.401  -0.090  0.00  0.00    -0.309 N 
ATOM     18  H   LIG    1       -0.661  -2.647  -0.540  0.00  0.00    +0.149 HD
ATOM     19  C   LIG    1       -1.771  -1.054   0.102  0.00  0.00    +0.239 C 
ATOM     20  O   LIG    1       -2.705  -0.617   0.777  0.00  0.00    -0.273 OA
BRANCH  17  22
ATOM     21  C   LIG    1       -1.695  -4.827   0.042  0.00  0.00    +0.031 C 
ATOM     22  C   LIG    1       -2.280  -3.497   0.552  0.00  0.00    +0.026 C 
ATOM     23  C   LIG    1       -2.119  -3.446   2.079  0.00  0.00    +0.031 C 
ATOM     24  C   LIG    1       -3.769  -3.452   0.175  0.00  0.00    +0.031 C 
ENDBRANCH  17  22
ENDBRANCH   1  19
BRANCH   1  25
ATOM     25  N   LIG    1        0.409  -0.744  -1.150  0.00  0.00    -0.284 N 
ATOM     26  C   LIG    1        0.460  -1.235  -2.442  0.00  0.00    +0.329 C 
ATOM     27  O   LIG    1        1.368  -1.903  -2.915  0.00  0.00    -0.279 OA
BRANCH  25  28
ATOM     28  C   LIG    1        1.533  -1.001  -0.243  0.00  0.00    +0.143 C 
BRANCH  28  29
ATOM     29  C   LIG    1        2.527   0.137  -0.142  0.00  0.00    -0.030 A 
ATOM     30  C   LIG    1        2.954   0.852  -1.274  0.00  0.00    +0.008 A 
ATOM     31  C   LIG    1        3.868   1.900  -1.152  0.00  0.00    +0.038 A 
ATOM     32  C   LIG    1        4.376   2.225   0.098  0.00  0.00    +0.123 A 
ATOM     33  F   LIG    1        5.250   3.233   0.215  0.00  0.00    -0.205 F 
ATOM     34  C   LIG    1        3.997   1.513   1.228  0.00  0.00    +0.038 A 
ATOM     35  C   LIG    1        3.083   0.465   1.106  0.00  0.00    +0.008 A 
ENDBRANCH  28  29
ENDBRANCH  25  28
ENDBRANCH   1  25
TORSDOF 8