REMARK  Name = LIG001875
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        0.431   0.283  -0.881  0.00  0.00    -0.124 S 
ENDROOT
BRANCH   1   4
ATOM      2  C   LIG    1        3.884  -0.020   1.277  0.00  0.00    +0.026 A 
ATOM      3  C   LIG    1        2.609   0.356   0.843  0.00  0.00    +0.037 A 
ATOM      4  C   LIG    1        2.040  -0.221  -0.299  0.00  0.00    +0.010 A 
ATOM      5  C   LIG    1        2.748  -1.196  -1.003  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1        3.995  -1.620  -0.544  0.00  0.00    +0.003 A 
ATOM      7  C   LIG    1        4.546  -1.050   0.605  0.00  0.00    +0.023 A 
BRANCH   2   8
ATOM      8  N   LIG    1        4.389   0.470   2.488  0.00  0.00    -0.358 N 
ATOM      9  H   LIG    1        5.400   0.412   2.563  0.00  0.00    +0.142 HD
ATOM     10  H   LIG    1        4.040   1.392   2.733  0.00  0.00    +0.142 HD
ENDBRANCH   2   8
ENDBRANCH   1   4
BRANCH   1  11
ATOM     11  C   LIG    1       -0.592  -0.286   0.529  0.00  0.00    +0.087 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -2.091   0.008   0.376  0.00  0.00    +0.086 C 
ATOM     13  C   LIG    1       -2.390   1.493   0.510  0.00  0.00    +0.223 C 
ATOM     14  O   LIG    1       -1.694   2.267   1.161  0.00  0.00    -0.275 OA
ATOM     15  N   LIG    1       -3.566   1.925  -0.058  0.00  0.00    -0.256 N 
ATOM     16  H   LIG    1       -3.780   2.905   0.063  0.00  0.00    +0.157 HD
ATOM     17  C   LIG    1       -4.503   1.185  -0.735  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -5.548   1.695  -1.130  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -4.212  -0.286  -0.898  0.00  0.00    +0.097 C 
ATOM     20  C   LIG    1       -2.713  -0.550  -0.906  0.00  0.00    +0.023 C 
ENDBRANCH  11  12
ENDBRANCH   1  11
TORSDOF 4