REMARK  Name = LIG001815
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.024  -0.830   0.495  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.275  -1.972   0.765  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.642  -3.131   0.786  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.906  -1.535   1.053  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.891  -0.144   1.067  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -0.715   0.541   1.324  0.00  0.00    +0.011 A 
ATOM      7  C   LIG    1        0.456  -0.201   1.569  0.00  0.00    -0.030 A 
ATOM      8  C   LIG    1        0.412  -1.616   1.547  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -0.779  -2.297   1.291  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -3.265   0.379   0.816  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.285   0.434  -3.421  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.169  -0.005  -2.280  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.407   0.796  -1.193  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.690   1.743  -1.403  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -6.061   0.551   0.115  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -6.083   1.465   0.939  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -5.491  -0.842   0.433  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -6.063  -1.835  -0.585  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -5.698  -1.411  -1.999  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  C   LIG    1        1.762   0.502   1.844  0.00  0.00    +0.141 C 
BRANCH  20  21
ATOM     21  N   LIG    1        2.679   0.330   0.741  0.00  0.00    -0.295 N 
ATOM     22  H   LIG    1        2.278   0.395  -0.183  0.00  0.00    +0.151 HD
ATOM     23  C   LIG    1        3.966   0.814   0.858  0.00  0.00    +0.304 C 
ATOM     24  N   LIG    1        4.668   0.611  -0.305  0.00  0.00    -0.268 N 
ATOM     25  H   LIG    1        4.250  -0.028  -0.969  0.00  0.00    +0.156 HD
ATOM     26  O   LIG    1        4.379   1.329   1.887  0.00  0.00    -0.252 OA
BRANCH  24  27
ATOM     27  C   LIG    1        5.992   1.009  -0.606  0.00  0.00    +0.053 A 
ATOM     28  C   LIG    1        6.578   0.544  -1.799  0.00  0.00    +0.062 A 
ATOM     29 CL   LIG    1        5.705  -0.497  -2.874  0.00  0.00    -0.082 Cl
ATOM     30  C   LIG    1        7.881   0.908  -2.151  0.00  0.00    +0.022 A 
ATOM     31  C   LIG    1        8.615   1.746  -1.316  0.00  0.00    +0.002 A 
ATOM     32  C   LIG    1        8.045   2.219  -0.136  0.00  0.00    +0.002 A 
ATOM     33  C   LIG    1        6.741   1.854   0.217  0.00  0.00    +0.025 A 
ENDBRANCH  24  27
ENDBRANCH  20  21
ENDBRANCH   7  20
TORSDOF 4