REMARK  Name = LIG001038
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.153   0.066   0.127  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        2.053  -0.793   0.308  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1        0.773  -0.266   0.237  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -0.548  -0.944   0.370  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1       -1.489   0.164   0.285  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -0.857   1.355  -0.044  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1       -1.359   2.425  -0.325  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        0.586   1.089  -0.015  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        1.639   1.960  -0.205  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        2.935   1.435  -0.128  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -2.924  -0.068   0.150  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -3.322  -0.246  -1.324  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -2.582  -0.746  -2.170  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -4.623   0.072  -1.640  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -4.893  -0.081  -2.602  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -5.630   0.444  -0.785  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -6.789   0.542  -1.179  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -5.255   0.629   0.667  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -3.788   1.003   0.815  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  22
ATOM     20  C   LIG    1        6.813  -0.851   0.227  0.00  0.00    +0.109 C 
ATOM     21  C   LIG    1        5.660   0.113   0.092  0.00  0.00    +0.214 C 
ATOM     22  N   LIG    1        4.434  -0.519   0.208  0.00  0.00    -0.286 N 
ATOM     23  H   LIG    1        4.457  -1.516   0.381  0.00  0.00    +0.155 HD
ATOM     24  O   LIG    1        5.861   1.310  -0.073  0.00  0.00    -0.276 OA
ENDBRANCH   1  22
TORSDOF 2