REMARK  Name = LIG001615
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.279  -0.617   2.653  0.00  0.00    -0.010 A 
ATOM      2  C   LIG    1       -0.521   0.215   1.857  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -1.686  -0.319   1.337  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1       -2.702   0.321   0.494  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1       -3.630  -0.659   0.170  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -3.385  -1.898   0.894  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1       -2.704   1.495   0.180  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -2.082  -1.634   1.569  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1       -1.302  -2.471   2.346  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1       -0.115  -1.956   2.883  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -4.916  -0.393  -0.466  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -5.903   0.249   0.521  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -5.904   0.016   1.729  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -6.894   1.025  -0.036  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -7.563   1.417   0.612  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -7.158   1.226  -1.368  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -8.172   1.815  -1.729  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -6.194   0.605  -2.352  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -4.811   0.442  -1.742  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1        1.571  -0.098   3.232  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.671  -0.593   2.459  0.00  0.00    -0.445 OA
BRANCH  21  24
ATOM     22  N   LIG    1        4.164  -0.390   0.853  0.00  0.00    -0.251 N 
ATOM     23  H   LIG    1        4.335  -1.324   1.198  0.00  0.00    +0.158 HD
ATOM     24  C   LIG    1        3.149   0.251   1.507  0.00  0.00    +0.405 C 
ATOM     25  O   LIG    1        2.721   1.376   1.306  0.00  0.00    -0.226 OA
BRANCH  22  31
ATOM     26  C   LIG    1        7.492   1.340  -3.486  0.00  0.00    +0.045 C 
ATOM     27  C   LIG    1        6.623   0.883  -2.349  0.00  0.00    -0.032 A 
ATOM     28  C   LIG    1        6.761  -0.385  -1.768  0.00  0.00    +0.046 A 
ATOM     29 CL   LIG    1        7.950  -1.508  -2.328  0.00  0.00    -0.083 Cl
ATOM     30  C   LIG    1        5.936  -0.781  -0.710  0.00  0.00    +0.043 A 
ATOM     31  C   LIG    1        4.954   0.080  -0.210  0.00  0.00    +0.038 A 
ATOM     32  C   LIG    1        4.811   1.343  -0.785  0.00  0.00    +0.024 A 
ATOM     33  C   LIG    1        5.637   1.740  -1.843  0.00  0.00    +0.006 A 
ENDBRANCH  22  31
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 5