REMARK  Name = LIG001863
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.296  -0.310   0.252  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        0.388   0.295  -0.628  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1       -0.967   0.209  -0.347  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -2.130   0.737  -1.116  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1       -3.259   0.380  -0.268  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -2.876  -0.387   0.817  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1       -3.579  -0.937   1.641  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -1.412  -0.462   0.787  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1       -0.549  -1.072   1.674  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        0.819  -0.989   1.397  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -4.632   0.623  -0.696  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -5.297  -0.688  -1.116  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -4.887  -1.359  -2.063  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -6.352  -1.124  -0.355  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -6.762  -2.004  -0.635  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -6.829  -0.603   0.819  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -7.753  -1.153   1.415  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -6.165   0.643   1.349  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -5.482   1.452   0.263  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  21
ATOM     20  C   LIG    1        3.390   0.294  -0.978  0.00  0.00    +0.249 C 
ATOM     21  N   LIG    1        2.693  -0.281   0.068  0.00  0.00    -0.281 N 
ATOM     22  H   LIG    1        3.247  -0.765   0.764  0.00  0.00    +0.155 HD
ATOM     23  O   LIG    1        2.934   0.846  -1.970  0.00  0.00    -0.270 OA
BRANCH  20  26
ATOM     24  C   LIG    1        4.934   1.499   1.314  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1        5.586   0.698   0.223  0.00  0.00    -0.038 A 
ATOM     26  C   LIG    1        4.863   0.158  -0.858  0.00  0.00    +0.040 A 
ATOM     27  C   LIG    1        5.519  -0.538  -1.882  0.00  0.00    +0.013 A 
ATOM     28  C   LIG    1        6.897  -0.739  -1.818  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        7.619  -0.243  -0.735  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.970   0.470   0.277  0.00  0.00    +0.004 A 
ENDBRANCH  20  26
ENDBRANCH   1  21
TORSDOF 3