REMARK  Name = LIG000190
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.709  -0.740  -0.773  0.00  0.00    +0.265 C 
ATOM      2  N   LIG    1        0.229   0.000  -0.072  0.00  0.00    -0.203 N 
ATOM      3  H   LIG    1       -0.059   0.680   0.623  0.00  0.00    +0.178 HD
ATOM      4  O   LIG    1       -0.489  -1.664  -1.546  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1       -1.826   1.961  -1.432  0.00  0.00    +0.066 C 
ATOM      6  C   LIG    1       -2.625   0.888  -0.753  0.00  0.00    +0.051 A 
ATOM      7  C   LIG    1       -2.106  -0.373  -0.482  0.00  0.00    +0.060 A 
ATOM      8  C   LIG    1       -2.939  -1.340   0.076  0.00  0.00    +0.025 A 
ATOM      9  C   LIG    1       -4.263  -1.016   0.394  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -4.715   0.297   0.132  0.00  0.00    +0.074 A 
ATOM     11  C   LIG    1       -6.037   0.618   0.462  0.00  0.00    -0.025 A 
ATOM     12  C   LIG    1       -6.889  -0.343   1.034  0.00  0.00    +0.005 A 
ATOM     13  C   LIG    1       -6.432  -1.632   1.283  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -6.560   2.004   0.194  0.00  0.00    +0.046 C 
ATOM     15  C   LIG    1       -5.121  -1.969   0.964  0.00  0.00    +0.010 A 
ATOM     16  N   LIG    1       -3.901   1.222  -0.425  0.00  0.00    -0.251 NA
ENDBRANCH   1   7
BRANCH   2  17
ATOM     17  N   LIG    1        1.556  -0.256  -0.251  0.00  0.00    -0.187 NA
ATOM     18  C   LIG    1        2.374   0.443   0.466  0.00  0.00    +0.140 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.806   0.242   0.345  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1        4.518  -0.677  -0.496  0.00  0.00    +0.009 A 
ATOM     21  C   LIG    1        5.880  -0.495  -0.256  0.00  0.00    +0.047 A 
ATOM     22  C   LIG    1        6.875  -1.232  -0.910  0.00  0.00    +0.026 A 
ATOM     23  C   LIG    1        6.467  -2.189  -1.843  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1        5.117  -2.398  -2.108  0.00  0.00    +0.001 A 
ATOM     25  N   LIG    1        5.995   0.492   0.692  0.00  0.00    -0.358 N 
ATOM     26  H   LIG    1        6.878   0.826   1.054  0.00  0.00    +0.166 HD
ATOM     27  C   LIG    1        4.137  -1.652  -1.444  0.00  0.00    +0.010 A 
ATOM     28  C   LIG    1        4.757   0.952   1.069  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1        4.613   2.025   2.087  0.00  0.00    +0.064 C 
ENDBRANCH  18  19
ENDBRANCH   2  17
TORSDOF 3