REMARK  Name = LIG000247
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.135   0.417   0.126  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        2.016  -0.381  -0.141  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1        0.772   0.129   0.186  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1       -0.562  -0.446   0.019  0.00  0.00    +0.255 C 
ATOM      5  N   LIG    1       -1.449   0.458   0.541  0.00  0.00    -0.222 N 
ATOM      6  C   LIG    1       -0.814   1.596   0.959  0.00  0.00    +0.254 C 
ATOM      7  O   LIG    1       -1.292   2.614   1.422  0.00  0.00    -0.270 OA
ATOM      8  O   LIG    1       -0.789  -1.515  -0.512  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        0.615   1.378   0.754  0.00  0.00    +0.050 A 
ATOM     10  C   LIG    1        1.692   2.194   1.026  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1        2.962   1.700   0.705  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   5  12
ATOM     12  C   LIG    1       -2.897   0.354   0.450  0.00  0.00    +0.171 C 
ATOM     13  C   LIG    1       -3.334   0.648  -0.990  0.00  0.00    +0.240 C 
ATOM     14  O   LIG    1       -2.671   1.309  -1.786  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -4.582   0.182  -1.340  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -4.882   0.389  -2.283  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -5.422  -0.617  -0.605  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -6.502  -0.986  -1.058  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -4.979  -0.955   0.800  0.00  0.00    +0.098 C 
ATOM     20  C   LIG    1       -3.462  -0.988   0.909  0.00  0.00    +0.041 C 
ENDBRANCH   5  12
BRANCH   1  23
ATOM     21  C   LIG    1        6.383  -1.239  -0.856  0.00  0.00    +0.109 C 
ATOM     22  C   LIG    1        4.886  -1.185  -0.673  0.00  0.00    +0.214 C 
ATOM     23  N   LIG    1        4.461   0.026  -0.156  0.00  0.00    -0.286 N 
ATOM     24  H   LIG    1        5.183   0.701   0.062  0.00  0.00    +0.155 HD
ATOM     25  O   LIG    1        4.186  -2.154  -0.943  0.00  0.00    -0.276 OA
ENDBRANCH   1  23
TORSDOF 2