REMARK  Name = LIG001123
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.856  -0.513  -0.339  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.347  -1.808  -0.301  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.956  -2.859  -0.307  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.885  -1.695  -0.271  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.552  -0.353  -0.409  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -0.223   0.040  -0.419  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        0.778  -0.940  -0.284  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1        0.411  -2.293  -0.144  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -0.933  -2.684  -0.140  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.791   0.463  -0.566  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.524   1.853   2.709  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.290   1.198   1.698  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.121   1.818   0.486  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.214   2.824   0.498  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.557   1.284  -0.648  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -5.179   2.027  -1.555  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -5.266  -0.226  -0.635  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -6.247  -0.895   0.336  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -6.102  -0.299   1.728  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        2.114  -0.483  -0.294  0.00  0.00    -0.280 N 
ATOM     21  H   LIG    1        2.235   0.512  -0.404  0.00  0.00    +0.155 HD
ATOM     22  C   LIG    1        3.274  -1.244  -0.226  0.00  0.00    +0.268 C 
ATOM     23  O   LIG    1        3.309  -2.468  -0.177  0.00  0.00    -0.268 OA
BRANCH  22  24
ATOM     24  C   LIG    1        4.519  -0.447  -0.228  0.00  0.00    +0.144 A 
ATOM     25  N   LIG    1        5.766  -1.031  -0.402  0.00  0.00    -0.223 NA
ATOM     26  C   LIG    1        6.646  -0.059  -0.340  0.00  0.00    +0.139 A 
ATOM     27  N   LIG    1        6.025   1.165  -0.126  0.00  0.00    -0.303 N 
ATOM     28  C   LIG    1        6.715   2.368  -0.013  0.00  0.00    +0.131 A 
ATOM     29  C   LIG    1        8.050   2.350  -0.119  0.00  0.00    +0.140 A 
ATOM     30  C   LIG    1        8.745   1.097  -0.344  0.00  0.00    +0.043 A 
ATOM     31  F   LIG    1        8.771   3.482  -0.019  0.00  0.00    -0.204 F 
ATOM     32  C   LIG    1        8.067  -0.063  -0.450  0.00  0.00    +0.049 A 
ATOM     33  C   LIG    1        4.675   0.921  -0.055  0.00  0.00    +0.125 A 
ENDBRANCH  22  24
ENDBRANCH   7  20
TORSDOF 3