File: macrocycle-5-meta-Cl-ortho-hash.sdf.expected.cxsmi

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C1(Cl)=C2C(F)=CC=C1CCCCCC1=C2C=C(F)C=C1Cl |(0.707022,0.816412,;0.344026,1.81374,;0.707028,0,;1.41406,-0.408198,;1.41406,-1.2246,;2.12108,0,;2.12108,0.816415,;1.41405,1.22462,;1.41404,2.04103,;0.70701,2.44923,;0,2.04102,;0,1.22461,;-0.707035,0.816401,;-0.707029,0,;0,-0.408203,;0,-1.22461,;-0.707017,-1.63282,;-0.707017,-2.44923,;-1.41405,-1.22462,;-1.41406,-0.408215,;-2.12108,0,),wD:14.16|