REMARK  Name = BDB060364
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.779   0.771  -0.342  0.00  0.00    +0.149 A 
ATOM      2  N   LIG    1       -2.815   1.691  -0.664  0.00  0.00    -0.197 N 
ATOM      3  C   LIG    1       -2.532   2.885  -1.339  0.00  0.00    +0.159 A 
ATOM      4  C   LIG    1       -3.729   3.546  -1.483  0.00  0.00    +0.090 A 
ATOM      5  C   LIG    1       -4.671   2.710  -0.877  0.00  0.00    +0.153 A 
ATOM      6 CL   LIG    1       -6.332   3.017  -0.749  0.00  0.00    -0.060 Cl
ATOM      7  N   LIG    1       -1.272   3.224  -1.733  0.00  0.00    -0.234 NA
ATOM      8  C   LIG    1       -0.331   2.377  -1.427  0.00  0.00    +0.140 A 
ATOM      9  N   LIG    1       -4.146   1.595  -0.378  0.00  0.00    -0.152 NA
ATOM     10  C   LIG    1       -0.510   1.083  -0.696  0.00  0.00    +0.093 A 
ENDROOT
BRANCH   1  13
ATOM     11  C   LIG    1       -2.268  -1.986  -1.597  0.00  0.00    +0.030 C 
ATOM     12  C   LIG    1       -2.963  -1.449  -0.344  0.00  0.00    +0.098 C 
ATOM     13  N   LIG    1       -2.072  -0.448   0.348  0.00  0.00    -0.304 N 
ATOM     14  C   LIG    1       -2.299  -0.438   1.842  0.00  0.00    +0.098 C 
ATOM     15  C   LIG    1       -1.968   0.889   2.522  0.00  0.00    +0.030 C 
ATOM     16  C   LIG    1       -3.737  -0.881   2.184  0.00  0.00    +0.182 C 
ATOM     17  O   LIG    1       -4.010  -2.232   1.780  0.00  0.00    -0.376 OA
ATOM     18  C   LIG    1       -3.297  -2.624   0.602  0.00  0.00    +0.182 C 
ENDBRANCH   1  13
BRANCH  10  19
ATOM     19  N   LIG    1        0.509   0.204  -0.397  0.00  0.00    -0.265 N 
ATOM     20  H   LIG    1        0.183  -0.617   0.100  0.00  0.00    +0.157 HD
ATOM     21  C   LIG    1        1.869   0.392  -0.523  0.00  0.00    +0.308 C 
ATOM     22  N   LIG    1        2.558  -0.762  -0.191  0.00  0.00    -0.269 N 
ATOM     23  H   LIG    1        1.998  -1.592  -0.070  0.00  0.00    +0.156 HD
ATOM     24  O   LIG    1        2.382   1.443  -0.881  0.00  0.00    -0.252 OA
BRANCH  22  25
ATOM     25  C   LIG    1        3.958  -0.939  -0.132  0.00  0.00    +0.038 A 
ATOM     26  C   LIG    1        4.882   0.091  -0.293  0.00  0.00    +0.055 A 
ATOM     27  C   LIG    1        6.247  -0.193  -0.209  0.00  0.00    +0.145 A 
ATOM     28  N   LIG    1        6.707  -1.455   0.027  0.00  0.00    -0.251 NA
ATOM     29  C   LIG    1        5.795  -2.434   0.184  0.00  0.00    +0.113 A 
ATOM     30  C   LIG    1        4.429  -2.228   0.116  0.00  0.00    +0.043 A 
BRANCH  27  31
ATOM     31  C   LIG    1        7.240   0.948  -0.396  0.00  0.00    +0.434 C 
ATOM     32  F   LIG    1        8.544   0.593  -0.209  0.00  0.00    -0.164 F 
ATOM     33  F   LIG    1        7.181   1.494  -1.645  0.00  0.00    -0.164 F 
ATOM     34  F   LIG    1        7.014   1.983   0.467  0.00  0.00    -0.164 F 
ENDBRANCH  27  31
ENDBRANCH  22  25
ENDBRANCH  10  19
TORSDOF 4