REMARK Name = LIG000564 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 3.912 1.207 0.025 0.00 0.00 +0.025 A ATOM 2 C LIG 1 3.510 0.035 0.673 0.00 0.00 +0.035 A ATOM 3 C LIG 1 2.293 -0.602 0.359 0.00 0.00 +0.069 A ATOM 4 C LIG 1 1.465 -0.016 -0.609 0.00 0.00 +0.048 A ATOM 5 C LIG 1 1.834 1.186 -1.227 0.00 0.00 +0.015 A ATOM 6 C LIG 1 3.041 1.801 -0.890 0.00 0.00 +0.023 A ENDROOT BRANCH 3 7 ATOM 7 C LIG 1 1.902 -1.871 1.072 0.00 0.00 +0.418 C ATOM 8 F LIG 1 2.619 -2.060 2.221 0.00 0.00 -0.166 F ATOM 9 F LIG 1 2.113 -2.993 0.335 0.00 0.00 -0.166 F ATOM 10 F LIG 1 0.599 -1.891 1.471 0.00 0.00 -0.166 F ENDBRANCH 3 7 BRANCH 4 11 ATOM 11 C LIG 1 0.195 -0.663 -1.001 0.00 0.00 +0.245 C ATOM 12 N LIG 1 -0.924 0.132 -0.929 0.00 0.00 -0.300 N ATOM 13 H LIG 1 -0.809 1.126 -0.758 0.00 0.00 +0.150 HD ATOM 14 O LIG 1 0.192 -1.835 -1.347 0.00 0.00 -0.270 OA BRANCH 12 15 ATOM 15 C LIG 1 -2.216 -0.331 -1.422 0.00 0.00 +0.160 C ATOM 16 C LIG 1 -3.143 0.888 -1.505 0.00 0.00 +0.240 C ATOM 17 O LIG 1 -2.875 1.870 -2.199 0.00 0.00 -0.273 OA ATOM 18 N LIG 1 -4.215 0.914 -0.650 0.00 0.00 -0.255 N ATOM 19 H LIG 1 -4.771 1.758 -0.691 0.00 0.00 +0.158 HD ATOM 20 C LIG 1 -4.269 0.274 0.561 0.00 0.00 +0.219 C ATOM 21 O LIG 1 -5.007 0.681 1.453 0.00 0.00 -0.275 OA ATOM 22 C LIG 1 -3.313 -0.876 0.765 0.00 0.00 +0.098 C ATOM 23 C LIG 1 -2.840 -1.434 -0.567 0.00 0.00 +0.041 C ENDBRANCH 12 15 ENDBRANCH 4 11 BRANCH 1 24 ATOM 24 N LIG 1 5.057 1.885 0.447 0.00 0.00 -0.358 N ATOM 25 H LIG 1 5.772 1.290 0.855 0.00 0.00 +0.142 HD ATOM 26 H LIG 1 5.442 2.527 -0.240 0.00 0.00 +0.142 HD ENDBRANCH 1 24 TORSDOF 4