REMARK  Name = LIG000394
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.291   0.709  -0.489  0.00  0.00    +0.121 A 
ATOM      2  C   LIG    1        0.858   1.514  -0.475  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1        2.090   0.914  -0.282  0.00  0.00    -0.015 A 
ATOM      4  C   LIG    1        3.452   1.518  -0.251  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1        4.299   0.380   0.080  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        3.590  -0.812   0.074  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1        4.015  -1.946   0.175  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.176  -0.462  -0.102  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        1.066  -1.283  -0.104  0.00  0.00    +0.017 A 
ATOM     10  C   LIG    1       -0.183  -0.682  -0.296  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        5.754   0.472   0.010  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        6.264   0.149  -1.403  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        5.627   0.389  -2.427  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        7.554  -0.325  -1.484  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        7.900  -0.504  -2.416  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        8.463  -0.474  -0.467  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        9.631  -0.770  -0.701  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        7.975  -0.165   0.930  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.475  -0.383   1.051  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  O   LIG    1       -1.456   1.404  -0.674  0.00  0.00    -0.488 OA
BRANCH  20  21
ATOM     21  C   LIG    1       -2.653   0.671  -1.012  0.00  0.00    +0.187 C 
ATOM     22  C   LIG    1       -3.426   1.593  -1.962  0.00  0.00    +0.053 C 
BRANCH  21  24
ATOM     23  N   LIG    1       -4.164  -1.008   0.239  0.00  0.00    -0.296 NA
ATOM     24  C   LIG    1       -3.414   0.281   0.300  0.00  0.00    +0.097 C 
ATOM     25  C   LIG    1       -4.269   1.435   0.873  0.00  0.00    +0.022 C 
ATOM     26  C   LIG    1       -4.862   1.074   2.233  0.00  0.00    +0.003 C 
ATOM     27  C   LIG    1       -5.576  -0.272   2.183  0.00  0.00    +0.015 C 
ATOM     28  C   LIG    1       -4.674  -1.348   1.580  0.00  0.00    +0.085 C 
BRANCH  23  30
ATOM     29  C   LIG    1       -5.899  -2.413  -0.926  0.00  0.00    +0.020 C 
ATOM     30  C   LIG    1       -5.182  -1.068  -0.818  0.00  0.00    +0.081 C 
ENDBRANCH  23  30
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 5