File: AtropCanon2.cxsmi.arom_expected.cxsmi

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Cc1ccc(Cl)c(C)c1-n1cccc1Cl |(-1.0493,3.7687,;0.2229,2.9739,;1.5472,3.678,;2.8194,2.8831,;2.7669,1.3842,;4.039,0.5893,;1.4425,0.6798,;1.3902,-0.8192,;0.1704,1.4748,;-1.154,0.7705,;-1.6175,-0.6561,;-3.1175,-0.6561,;-3.5811,0.7705,;-2.3675,1.6522,;-2.3675,3.1522,),wU:8.7|