REMARK  Name = LIG000380
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.098   2.652  -0.131  0.00  0.00    -0.280 N 
ATOM      2  C   LIG    1       -1.628   1.352  -0.117  0.00  0.00    +0.172 A 
ATOM      3  C   LIG    1       -0.254   1.462  -0.208  0.00  0.00    +0.148 A 
ATOM      4  C   LIG    1        0.474   0.264  -0.216  0.00  0.00    +0.152 A 
ATOM      5  N   LIG    1       -0.223  -0.896  -0.133  0.00  0.00    -0.197 NA
ATOM      6  C   LIG    1       -1.573  -0.900  -0.043  0.00  0.00    +0.222 A 
ATOM      7  N   LIG    1        0.146   2.776  -0.262  0.00  0.00    -0.230 NA
ATOM      8  N   LIG    1       -2.330   0.210  -0.034  0.00  0.00    -0.194 NA
ATOM      9  C   LIG    1       -0.979   3.458  -0.216  0.00  0.00    +0.206 A 
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1       -6.206   5.400   0.041  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1       -5.262   4.309   0.010  0.00  0.00    -0.272 N 
ATOM     12  N   LIG    1       -5.713   3.043   0.062  0.00  0.00    -0.178 NA
ATOM     13  C   LIG    1       -4.601   2.303   0.012  0.00  0.00    +0.160 A 
ATOM     14  C   LIG    1       -3.442   3.097  -0.066  0.00  0.00    +0.087 A 
ATOM     15  C   LIG    1       -3.900   4.397  -0.068  0.00  0.00    +0.134 A 
ENDBRANCH   1  14
BRANCH   6  16
ATOM     16  N   LIG    1       -2.222  -2.138   0.007  0.00  0.00    -0.295 N 
ATOM     17  C   LIG    1       -1.375  -3.243   0.487  0.00  0.00    +0.136 C 
ATOM     18  C   LIG    1       -2.144  -4.571   0.413  0.00  0.00    +0.179 C 
ATOM     19  O   LIG    1       -3.389  -4.500   1.125  0.00  0.00    -0.377 OA
ATOM     20  C   LIG    1       -4.221  -3.481   0.550  0.00  0.00    +0.179 C 
ATOM     21  C   LIG    1       -3.556  -2.098   0.629  0.00  0.00    +0.136 C 
ENDBRANCH   6  16
BRANCH   4  22
ATOM     22  N   LIG    1        1.873   0.261  -0.328  0.00  0.00    -0.320 N 
ATOM     23  H   LIG    1        2.217   1.191  -0.087  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  C   LIG    1        2.520  -0.803   0.433  0.00  0.00    +0.177 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.002  -0.841   0.220  0.00  0.00    +0.125 A 
ATOM     26  N   LIG    1        4.540  -0.738  -1.040  0.00  0.00    -0.341 N 
ATOM     27  H   LIG    1        3.998  -0.612  -1.886  0.00  0.00    +0.167 HD
ATOM     28  C   LIG    1        5.904  -0.801  -0.931  0.00  0.00    +0.068 A 
ATOM     29  C   LIG    1        6.132  -0.942   0.432  0.00  0.00    +0.091 A 
ATOM     30  C   LIG    1        7.448  -1.037   0.905  0.00  0.00    +0.051 A 
ATOM     31  C   LIG    1        8.499  -0.985  -0.022  0.00  0.00    +0.061 A 
ATOM     32  C   LIG    1        8.242  -0.840  -1.394  0.00  0.00    +0.061 A 
ATOM     33 CL   LIG    1        9.515  -0.772  -2.565  0.00  0.00    -0.082 Cl
ATOM     34 CL   LIG    1       10.109  -1.106   0.604  0.00  0.00    -0.082 Cl
ATOM     35  C   LIG    1        6.929  -0.744  -1.878  0.00  0.00    +0.049 A 
ATOM     36  N   LIG    1        4.950  -0.963   1.128  0.00  0.00    -0.231 NA
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   4  22
TORSDOF 5