REMARK  Name = BDB032150
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -5.002   0.582  -0.665  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -4.199  -0.540  -0.495  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -4.218  -1.579  -1.126  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -3.283  -0.242   0.612  0.00  0.00    +0.045 A 
ATOM      5  C   LIG    1       -3.522   1.065   1.023  0.00  0.00    +0.017 A 
ATOM      6  C   LIG    1       -2.780   1.599   2.049  0.00  0.00    +0.129 A 
ATOM      7  C   LIG    1       -1.792   0.822   2.659  0.00  0.00    +0.045 A 
ATOM      8  C   LIG    1       -1.546  -0.505   2.231  0.00  0.00    -0.007 A 
ATOM      9  F   LIG    1       -2.989   2.858   2.454  0.00  0.00    -0.205 F 
ATOM     10  C   LIG    1       -2.311  -1.045   1.183  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1       -4.586   1.688   0.192  0.00  0.00    +0.147 C 
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -7.674   2.855  -4.886  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -7.150   2.167  -4.015  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -5.810   1.881  -4.051  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -5.298   2.357  -4.782  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -5.044   1.471  -2.983  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -3.836   1.691  -2.963  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -5.817   0.755  -1.863  0.00  0.00    +0.163 C 
ATOM     19  C   LIG    1       -7.108   1.520  -1.594  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1       -7.937   1.572  -2.870  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  C   LIG    1       -0.436  -1.314   2.859  0.00  0.00    +0.269 C 
BRANCH  21  22
ATOM     22  O   LIG    1        0.800  -0.731   2.433  0.00  0.00    -0.445 OA
BRANCH  22  23
ATOM     23  C   LIG    1        1.857  -1.583   2.390  0.00  0.00    +0.405 C 
ATOM     24  N   LIG    1        2.926  -0.895   1.891  0.00  0.00    -0.251 N 
ATOM     25  H   LIG    1        2.729   0.080   1.711  0.00  0.00    +0.158 HD
ATOM     26  O   LIG    1        1.810  -2.749   2.745  0.00  0.00    -0.226 OA
BRANCH  24  27
ATOM     27  C   LIG    1        4.206  -1.376   1.567  0.00  0.00    +0.040 A 
ATOM     28  C   LIG    1        5.130  -0.451   1.064  0.00  0.00    +0.069 A 
ATOM     29  C   LIG    1        6.414  -0.852   0.678  0.00  0.00    +0.123 A 
ATOM     30  C   LIG    1        6.783  -2.190   0.796  0.00  0.00    +0.046 A 
ATOM     31  C   LIG    1        5.874  -3.115   1.310  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        4.591  -2.711   1.697  0.00  0.00    +0.023 A 
BRANCH  29  33
ATOM     33  O   LIG    1        7.217   0.155   0.202  0.00  0.00    -0.489 OA
BRANCH  33  34
ATOM     34  C   LIG    1        8.502  -0.222  -0.323  0.00  0.00    +0.174 C 
ATOM     35  C   LIG    1        8.561  -0.524  -1.795  0.00  0.00    +0.048 C 
ATOM     36  C   LIG    1        9.107   0.773  -1.277  0.00  0.00    +0.048 C 
ENDBRANCH  33  34
ENDBRANCH  29  33
ENDBRANCH  24  27
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH   8  21
TORSDOF 7