REMARK  Name = LIG001741
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.095   0.707  -0.080  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1        2.861   1.252   0.305  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1        1.727   0.461   0.224  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1        0.308   0.795   0.544  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1       -0.378  -0.467   0.289  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        0.480  -1.447  -0.185  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1        0.197  -2.567  -0.565  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.825  -0.864  -0.192  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        3.028  -1.450  -0.530  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        4.173  -0.652  -0.448  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -1.830  -0.615   0.248  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -2.598   0.175   1.321  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -2.093   0.626   2.346  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -3.946   0.337   1.092  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -4.445   0.862   1.797  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -4.606   0.186  -0.101  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -5.752   0.602  -0.245  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -3.864  -0.539  -1.196  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -2.373  -0.249  -1.135  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  N   LIG    1        5.271   1.444   0.110  0.00  0.00    -0.358 N 
ATOM     21  H   LIG    1        6.055   1.125  -0.451  0.00  0.00    +0.142 HD
ATOM     22  H   LIG    1        5.146   2.450   0.063  0.00  0.00    +0.142 HD
ENDBRANCH   1  20
TORSDOF 2