REMARK  Name = LIG000423
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.040  -0.006  -0.660  0.00  0.00    -0.035 A 
ATOM      2  C   LIG    1        4.532  -0.484   0.555  0.00  0.00    +0.008 A 
ATOM      3  C   LIG    1        3.165  -0.400   0.833  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        2.280   0.159  -0.090  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1        2.777   0.640  -1.300  0.00  0.00    +0.046 A 
ATOM      6  C   LIG    1        4.146   0.559  -1.582  0.00  0.00    +0.008 A 
ENDROOT
BRANCH   1  13
ATOM      7  O   LIG    1       10.527  -0.706  -0.132  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1        9.334  -0.495  -0.324  0.00  0.00    +0.219 C 
ATOM      9  N   LIG    1        8.450  -1.529  -0.502  0.00  0.00    -0.256 N 
ATOM     10  H   LIG    1        8.845  -2.459  -0.459  0.00  0.00    +0.157 HD
ATOM     11  C   LIG    1        7.123  -1.462  -0.859  0.00  0.00    +0.227 C 
ATOM     12  O   LIG    1        6.511  -2.495  -1.123  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        6.525  -0.060  -0.979  0.00  0.00    +0.106 C 
ATOM     14  C   LIG    1        7.295   0.927  -0.094  0.00  0.00    +0.026 C 
ATOM     15  C   LIG    1        8.771   0.898  -0.455  0.00  0.00    +0.097 C 
ENDBRANCH   1  13
BRANCH   4  16
ATOM     16  O   LIG    1        0.974   0.177   0.312  0.00  0.00    -0.487 OA
BRANCH  16  17
ATOM     17  C   LIG    1        0.015   0.687  -0.614  0.00  0.00    +0.264 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.367   0.551  -0.018  0.00  0.00    -0.010 A 
ATOM     19  C   LIG    1       -1.816  -0.687   0.461  0.00  0.00    +0.007 A 
ATOM     20  C   LIG    1       -3.103  -0.824   0.988  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -3.970   0.275   1.040  0.00  0.00    -0.033 A 
ATOM     22  C   LIG    1       -3.522   1.512   0.556  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -2.236   1.649   0.029  0.00  0.00    +0.007 A 
BRANCH  21  24
ATOM     24  C   LIG    1       -5.362   0.135   1.620  0.00  0.00    +0.119 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -6.429   0.456   0.659  0.00  0.00    -0.294 NA
ATOM     26  C   LIG    1       -7.756   0.495   1.311  0.00  0.00    +0.113 C 
ATOM     27  C   LIG    1       -8.576  -0.788   1.110  0.00  0.00    +0.175 C 
ATOM     28  O   LIG    1       -8.827  -1.087  -0.270  0.00  0.00    -0.377 OA
ATOM     29  C   LIG    1       -7.817  -0.570  -1.149  0.00  0.00    +0.175 C 
ATOM     30  C   LIG    1       -6.437  -0.490  -0.481  0.00  0.00    +0.113 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   4  16
TORSDOF 6