REMARK  Name = LIG000058
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.652  -1.217   2.782  0.00  0.00    +0.152 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        3.044   0.097   0.438  0.00  0.00    +0.165 A 
ATOM      3  S   LIG    1        3.805   0.996   1.671  0.00  0.00    -0.060 S 
ATOM      4  C   LIG    1        2.672   0.376   2.798  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        1.788  -0.474   2.159  0.00  0.00    +0.059 A 
ATOM      6  N   LIG    1        2.004  -0.616   0.790  0.00  0.00    -0.229 NA
BRANCH   2   9
ATOM      7  C   LIG    1        2.075  -1.329  -1.952  0.00  0.00    +0.109 C 
ATOM      8  C   LIG    1        3.240  -0.376  -1.941  0.00  0.00    +0.216 C 
ATOM      9  N   LIG    1        3.620   0.238  -0.789  0.00  0.00    -0.265 N 
ATOM     10  H   LIG    1        4.418   0.853  -0.861  0.00  0.00    +0.157 HD
ATOM     11  O   LIG    1        3.868  -0.136  -2.975  0.00  0.00    -0.276 OA
ENDBRANCH   2   9
ENDBRANCH   1   5
BRANCH   1  12
ATOM     12  C   LIG    1       -0.687  -0.565   2.479  0.00  0.00    +0.224 C 
ATOM     13  N   LIG    1       -0.897  -0.380   1.130  0.00  0.00    -0.264 N 
ATOM     14  H   LIG    1       -0.146  -0.570   0.477  0.00  0.00    +0.157 HD
ATOM     15  O   LIG    1       -1.464  -0.301   3.392  0.00  0.00    -0.275 OA
BRANCH  13  16
ATOM     16  C   LIG    1       -2.037   0.170   0.623  0.00  0.00    +0.165 A 
ATOM     17  S   LIG    1       -2.008   0.383  -1.072  0.00  0.00    -0.057 S 
ATOM     18  C   LIG    1       -3.591   1.042  -1.000  0.00  0.00    +0.008 A 
ATOM     19  C   LIG    1       -4.287   1.501  -2.228  0.00  0.00    +0.053 C 
ATOM     20  C   LIG    1       -4.021   1.048   0.312  0.00  0.00    +0.124 A 
ATOM     21  N   LIG    1       -3.127   0.546   1.237  0.00  0.00    -0.233 NA
ENDBRANCH  13  16
ENDBRANCH   1  12
TORSDOF 4