REMARK  Name = BDB018352
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.391  -4.540   0.849  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -1.728  -3.155   0.556  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1       -3.062  -2.773   0.523  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1       -4.016  -3.517   0.730  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1       -3.313  -1.345   0.215  0.00  0.00    +0.079 A 
ATOM      6  C   LIG    1       -2.304  -0.491  -0.036  0.00  0.00    -0.004 A 
ATOM      7  C   LIG    1       -0.910  -0.967  -0.001  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -0.700  -2.266   0.296  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1       -2.704   0.910  -0.289  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1       -3.325   1.268  -1.495  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1       -3.694   2.595  -1.731  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1       -3.443   3.566  -0.763  0.00  0.00    +0.041 A 
ATOM     13 CL   LIG    1       -3.898   5.200  -1.055  0.00  0.00    -0.084 Cl
ATOM     14  C   LIG    1       -2.828   3.224   0.439  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -2.459   1.897   0.676  0.00  0.00    +0.010 A 
ENDBRANCH   6   9
BRANCH   7  16
ATOM     16  C   LIG    1        0.197  -0.098  -0.275  0.00  0.00    +0.022 A 
ATOM     17  C   LIG    1        1.333   0.041   0.492  0.00  0.00    +0.116 A 
ATOM     18  N   LIG    1        2.113   0.962  -0.150  0.00  0.00    -0.271 N 
ATOM     19  N   LIG    1        1.562   1.428  -1.289  0.00  0.00    -0.179 NA
ATOM     20  C   LIG    1        0.395   0.781  -1.361  0.00  0.00    +0.143 A 
BRANCH  18  21
ATOM     21  C   LIG    1        3.416   1.451   0.282  0.00  0.00    +0.147 C 
BRANCH  21  22
ATOM     22  C   LIG    1        4.531   0.610  -0.262  0.00  0.00    +0.010 C 
ATOM     23  C   LIG    1        5.889   0.635   0.393  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1        5.035  -0.599   0.488  0.00  0.00    +0.005 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH   7  16
TORSDOF 4