REMARK  Name = LIG001168
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.864  -0.595   0.352  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.567   0.212  -0.732  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -4.327   0.686  -1.552  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -2.120   0.450  -0.702  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.606  -0.151   0.443  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -0.253  -0.075   0.726  0.00  0.00    +0.011 A 
ATOM      7  C   LIG    1        0.581   0.626  -0.165  0.00  0.00    -0.030 A 
ATOM      8  C   LIG    1        0.034   1.220  -1.328  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -1.333   1.140  -1.602  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -2.707  -0.800   1.212  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -8.573   0.672  -1.047  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -7.573   0.172  -0.536  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -7.069   0.672   0.636  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -7.530   1.500   0.984  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.940   0.288   1.311  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -5.523   0.949   2.264  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -5.206  -0.952   0.799  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -6.029  -1.789  -0.177  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -6.841  -0.982  -1.173  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  C   LIG    1        2.063   0.711   0.095  0.00  0.00    +0.141 C 
BRANCH  20  21
ATOM     21  N   LIG    1        2.773  -0.318  -0.632  0.00  0.00    -0.295 N 
ATOM     22  H   LIG    1        2.260  -1.161  -0.861  0.00  0.00    +0.151 HD
ATOM     23  C   LIG    1        4.113  -0.558  -0.552  0.00  0.00    +0.304 C 
ATOM     24  N   LIG    1        4.868   0.510  -0.135  0.00  0.00    -0.267 N 
ATOM     25  H   LIG    1        4.603   1.360  -0.619  0.00  0.00    +0.156 HD
ATOM     26  O   LIG    1        4.551  -1.655  -0.879  0.00  0.00    -0.252 OA
BRANCH  24  27
ATOM     27  C   LIG    1        6.263   0.393   0.120  0.00  0.00    +0.072 A 
ATOM     28  C   LIG    1        7.128   1.340  -0.458  0.00  0.00    +0.065 A 
ATOM     29 CL   LIG    1        6.511   2.622  -1.447  0.00  0.00    -0.082 Cl
ATOM     30  C   LIG    1        8.509   1.267  -0.269  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1        9.038   0.253   0.522  0.00  0.00    +0.044 A 
ATOM     32 CL   LIG    1       10.739   0.160   0.761  0.00  0.00    -0.083 Cl
ATOM     33  C   LIG    1        8.201  -0.669   1.144  0.00  0.00    +0.042 A 
ATOM     34  C   LIG    1        6.816  -0.594   0.958  0.00  0.00    +0.065 A 
ATOM     35 CL   LIG    1        5.849  -1.657   1.925  0.00  0.00    -0.082 Cl
ENDBRANCH  24  27
ENDBRANCH  20  21
ENDBRANCH   7  20
TORSDOF 4