REMARK  Name = LIG000152
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.522   0.279   0.637  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.952   0.059   1.887  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.509  -0.070   2.959  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.499   0.021   1.697  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.228   0.334   0.370  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1        0.081   0.376  -0.085  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        1.123   0.095   0.816  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1        0.820  -0.222   2.156  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -0.503  -0.258   2.610  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.500   0.619  -0.353  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.366  -2.376  -1.986  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.076  -1.468  -1.212  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -5.910  -0.185  -1.669  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.052  -0.057  -2.661  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.300   0.858  -1.014  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -4.942   1.854  -1.642  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.937   0.632   0.464  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.905  -0.408   1.042  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -5.817  -1.706   0.255  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        2.437   0.142   0.302  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1        2.516   0.385  -0.676  0.00  0.00    +0.155 HD
ATOM     22  C   LIG    1        3.619  -0.012   1.006  0.00  0.00    +0.248 C 
ATOM     23  O   LIG    1        3.744  -0.150   2.216  0.00  0.00    -0.270 OA
BRANCH  22  24
ATOM     24  C   LIG    1        4.854   0.040   0.173  0.00  0.00    +0.038 A 
ATOM     25  C   LIG    1        4.894  -0.547  -1.102  0.00  0.00    +0.030 A 
ATOM     26  C   LIG    1        6.095  -0.464  -1.829  0.00  0.00    +0.040 A 
ATOM     27  C   LIG    1        7.231   0.171  -1.321  0.00  0.00    +0.078 A 
ATOM     28  N   LIG    1        8.333   0.175  -2.159  0.00  0.00    -0.247 NA
ATOM     29  C   LIG    1        8.041  -0.453  -3.274  0.00  0.00    +0.157 A 
ATOM     30  C   LIG    1        7.172   0.737  -0.032  0.00  0.00    +0.029 A 
ATOM     31  S   LIG    1        6.452  -1.077  -3.402  0.00  0.00    -0.075 S 
ATOM     32  C   LIG    1        5.986   0.661   0.707  0.00  0.00    +0.015 A 
ENDBRANCH  22  24
ENDBRANCH   7  20
TORSDOF 3