REMARK  Name = BDB034167
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.752   1.707  -0.927  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1       -0.181   2.841  -1.036  0.00  0.00    +0.089 C 
ATOM      3  C   LIG    1       -1.559   2.485  -0.447  0.00  0.00    +0.051 C 
ATOM      4  C   LIG    1       -2.034   1.130  -0.898  0.00  0.00    -0.041 C 
ATOM      5  C   LIG    1       -1.197   0.268  -1.500  0.00  0.00    -0.008 C 
ATOM      6  C   LIG    1        0.261   0.564  -1.719  0.00  0.00    +0.112 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.449   0.790  -0.693  0.00  0.00    -0.016 A 
ATOM      8  C   LIG    1       -3.874  -0.063   0.344  0.00  0.00    -0.007 A 
ATOM      9  C   LIG    1       -2.901  -0.678   1.313  0.00  0.00    +0.047 C 
ATOM     10  C   LIG    1       -5.242  -0.369   0.453  0.00  0.00    +0.139 A 
ATOM     11  F   LIG    1       -5.632  -1.196   1.438  0.00  0.00    -0.204 F 
ATOM     12  C   LIG    1       -6.188   0.165  -0.428  0.00  0.00    +0.072 A 
ATOM     13  C   LIG    1       -5.750   1.022  -1.445  0.00  0.00    +0.016 A 
ATOM     14  C   LIG    1       -4.394   1.327  -1.578  0.00  0.00    +0.009 A 
BRANCH  12  15
ATOM     15  C   LIG    1       -7.647  -0.132  -0.340  0.00  0.00    +0.247 C 
ATOM     16  N   LIG    1       -8.060  -1.030   0.619  0.00  0.00    -0.314 N 
ATOM     17  H   LIG    1       -7.388  -1.383   1.292  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1       -9.456  -1.313   0.833  0.00  0.00    +0.128 C 
ATOM     19  O   LIG    1       -8.428   0.421  -1.109  0.00  0.00    -0.270 OA
ENDBRANCH  12  15
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1        2.105   2.109  -1.345  0.00  0.00    +0.121 C 
BRANCH  20  30
ATOM     21  C   LIG    1        6.360  -2.210   1.041  0.00  0.00    +0.019 A 
ATOM     22  C   LIG    1        5.425  -1.813   2.146  0.00  0.00    +0.252 A 
ATOM     23  O   LIG    1        5.519  -2.283   3.275  0.00  0.00    -0.268 OA
ATOM     24  N   LIG    1        4.451  -0.897   1.839  0.00  0.00    -0.321 N 
ATOM     25  H   LIG    1        3.829  -0.639   2.593  0.00  0.00    +0.169 HD
ATOM     26  C   LIG    1        4.293  -0.345   0.564  0.00  0.00    +0.068 A 
ATOM     27  C   LIG    1        5.149  -0.722  -0.469  0.00  0.00    +0.088 A 
ATOM     28  N   LIG    1        5.066  -0.240  -1.727  0.00  0.00    -0.253 NA
ATOM     29  C   LIG    1        4.078   0.655  -1.960  0.00  0.00    +0.116 A 
ATOM     30  C   LIG    1        3.164   1.091  -1.000  0.00  0.00    -0.013 A 
ATOM     31  C   LIG    1        3.290   0.576   0.297  0.00  0.00    +0.034 A 
ATOM     32  C   LIG    1        6.203  -1.690  -0.190  0.00  0.00    +0.038 A 
BRANCH  21  34
ATOM     33  C   LIG    1        8.595  -2.603   2.121  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1        7.424  -3.221   1.370  0.00  0.00    +0.037 C 
ENDBRANCH  21  34
ENDBRANCH  20  30
ENDBRANCH   1  20
TORSDOF 5