REMARK  Name = LIG001018
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.682   0.199  -0.661  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        1.810  -0.733  -1.680  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        2.805  -1.034  -2.310  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        0.488  -1.339  -1.870  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        0.089  -2.264  -2.815  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -1.240  -2.680  -2.780  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -2.122  -2.170  -1.807  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -1.701  -1.234  -0.841  0.00  0.00    -0.012 A 
ATOM      9  C   LIG    1       -0.372  -0.827  -0.899  0.00  0.00    -0.010 A 
ATOM     10  C   LIG    1        0.370   0.137  -0.032  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -2.630  -0.723   0.171  0.00  0.00    -0.017 A 
ATOM     12  C   LIG    1       -3.671   0.151  -0.199  0.00  0.00    +0.020 A 
ATOM     13  C   LIG    1       -4.548   0.639   0.786  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -4.373   0.246   2.106  0.00  0.00    +0.066 A 
ATOM     15  N   LIG    1       -5.368   0.878   2.805  0.00  0.00    -0.277 N 
ATOM     16  H   LIG    1       -5.556   0.823   3.800  0.00  0.00    +0.189 HD
ATOM     17  N   LIG    1       -6.166   1.652   2.047  0.00  0.00    -0.181 NA
ATOM     18  C   LIG    1       -3.357  -0.622   2.513  0.00  0.00    +0.028 A 
ATOM     19  C   LIG    1       -5.666   1.501   0.818  0.00  0.00    +0.142 A 
ATOM     20  C   LIG    1       -2.493  -1.096   1.518  0.00  0.00    +0.010 A 
ENDBRANCH   8  11
BRANCH   1  27
ATOM     21  O   LIG    1        6.719   1.494   1.159  0.00  0.00    -0.275 OA
ATOM     22  C   LIG    1        5.583   1.279   0.745  0.00  0.00    +0.219 C 
ATOM     23  N   LIG    1        4.865   0.196   1.185  0.00  0.00    -0.255 N 
ATOM     24  H   LIG    1        5.340  -0.417   1.833  0.00  0.00    +0.158 HD
ATOM     25  C   LIG    1        3.543  -0.099   0.938  0.00  0.00    +0.240 C 
ATOM     26  O   LIG    1        2.991  -1.021   1.538  0.00  0.00    -0.273 OA
ATOM     27  C   LIG    1        2.804   0.862  -0.006  0.00  0.00    +0.163 C 
ATOM     28  C   LIG    1        3.784   1.520  -0.977  0.00  0.00    +0.041 C 
ATOM     29  C   LIG    1        4.873   2.231  -0.189  0.00  0.00    +0.098 C 
ENDBRANCH   1  27
TORSDOF 2