REMARK  Name = LIG001768
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.055  -1.541   3.109  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1       -3.297  -0.969   1.806  0.00  0.00    -0.266 N 
ATOM      3  C   LIG    1       -2.347  -0.559   0.906  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1       -3.065  -0.086  -0.186  0.00  0.00    +0.024 A 
ATOM      5  C   LIG    1       -2.362   0.422  -1.292  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -0.959   0.430  -1.268  0.00  0.00    +0.024 A 
ATOM      7  C   LIG    1       -0.249  -0.059  -0.170  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1       -4.436  -0.266   0.161  0.00  0.00    +0.083 A 
ATOM      9  C   LIG    1       -0.943  -0.556   0.946  0.00  0.00    +0.051 A 
ATOM     10  N   LIG    1       -4.564  -0.805   1.381  0.00  0.00    -0.175 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -5.632   0.067  -0.682  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1       -5.885   1.564  -0.657  0.00  0.00    +0.228 C 
ATOM     13  O   LIG    1       -5.267   2.352  -1.373  0.00  0.00    -0.275 OA
ATOM     14  N   LIG    1       -6.843   2.028   0.209  0.00  0.00    -0.256 N 
ATOM     15  H   LIG    1       -6.995   3.027   0.199  0.00  0.00    +0.157 HD
ATOM     16  C   LIG    1       -7.777   1.298   0.897  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -8.696   1.856   1.492  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -7.603  -0.198   0.907  0.00  0.00    +0.097 C 
ATOM     19  C   LIG    1       -6.918  -0.698  -0.357  0.00  0.00    +0.028 C 
ENDBRANCH   8  11
BRANCH   7  20
ATOM     20  N   LIG    1        1.158  -0.062  -0.095  0.00  0.00    -0.269 N 
ATOM     21  H   LIG    1        1.569  -0.454   0.738  0.00  0.00    +0.156 HD
ATOM     22  C   LIG    1        2.056   0.209  -1.105  0.00  0.00    +0.304 C 
ATOM     23  N   LIG    1        3.347   0.207  -0.611  0.00  0.00    -0.295 N 
ATOM     24  H   LIG    1        3.436   0.577   0.323  0.00  0.00    +0.151 HD
ATOM     25  O   LIG    1        1.802   0.411  -2.284  0.00  0.00    -0.253 OA
BRANCH  23  26
ATOM     26  C   LIG    1        4.432   0.536  -1.503  0.00  0.00    +0.136 C 
BRANCH  26  27
ATOM     27  C   LIG    1        5.723   0.297  -0.768  0.00  0.00    -0.056 C 
ATOM     28  C   LIG    1        6.166  -1.143  -0.649  0.00  0.00    +0.032 C 
ATOM     29  C   LIG    1        7.301  -1.351   0.357  0.00  0.00    +0.005 C 
ATOM     30  C   LIG    1        8.372  -0.277   0.212  0.00  0.00    +0.004 C 
ATOM     31  C   LIG    1        7.783   1.119   0.415  0.00  0.00    +0.027 C 
ATOM     32  C   LIG    1        6.462   1.309  -0.273  0.00  0.00    -0.026 C 
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH   7  20
TORSDOF 4