REMARK  Name = LIG001304
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.583  -0.296  -0.938  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1       -1.641  -0.323   0.056  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1       -1.797  -0.480   1.251  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -0.347  -0.092  -0.586  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1       -0.583   0.114  -1.931  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        0.439   0.377  -2.817  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1        1.738   0.422  -2.296  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1        1.990   0.210  -0.917  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1        0.926  -0.050  -0.046  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1       -2.023   0.006  -2.149  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1       -2.566   0.159  -3.227  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -7.536   0.023   1.416  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -6.481  -0.104   0.800  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -5.703   0.986   0.497  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -6.021   1.872   0.864  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -4.486   1.004  -0.148  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -3.873   2.060  -0.290  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -4.021  -0.338  -0.724  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1       -4.491  -1.486   0.166  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1       -6.008  -1.441   0.278  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  N   LIG    1        3.332   0.279  -0.505  0.00  0.00    -0.280 N 
ATOM     22  H   LIG    1        4.037   0.489  -1.210  0.00  0.00    +0.155 HD
ATOM     23  C   LIG    1        3.847   0.095   0.765  0.00  0.00    +0.268 C 
ATOM     24  O   LIG    1        3.224  -0.178   1.783  0.00  0.00    -0.268 OA
BRANCH  23  25
ATOM     25  C   LIG    1        5.328   0.257   0.822  0.00  0.00    +0.144 A 
ATOM     26  N   LIG    1        5.963   0.550  -0.354  0.00  0.00    -0.247 NA
ATOM     27  C   LIG    1        7.307   0.688  -0.251  0.00  0.00    +0.131 A 
ATOM     28  C   LIG    1        7.985   0.542   0.950  0.00  0.00    +0.130 A 
ATOM     29  N   LIG    1        7.354   0.251   2.111  0.00  0.00    -0.259 NA
ATOM     30  C   LIG    1        6.006   0.111   2.022  0.00  0.00    +0.143 A 
ENDBRANCH  23  25
ENDBRANCH   8  21
TORSDOF 3