File: macrocycle-8-meta-broken-hash.sdf.expected.cxsmi

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C1=C(C2=CC(Cl)=CC(F)=C2)C(F)=CC=C1CCCCCCCC |(0.709511,0.436843,;0.709511,-0.382428,;0,-0.792063,;-0.709508,-0.382428,;-1.41902,-0.792063,;-2.12853,-0.382428,;-1.41902,-1.61133,;-0.709508,-2.02097,;-0.709508,-2.84024,;0,-1.61133,;1.41902,-0.792068,;1.41902,-1.61134,;2.12853,-0.382435,;2.12853,0.436836,;1.41902,0.846479,;1.41902,1.66575,;0.709511,2.07539,;0.41591,2.84024,;-0.403361,2.84024,;-0.696962,2.07539,;-1.41902,1.66575,;-1.41902,0.846479,;-0.709508,0.436843,),wD:2.9|