1-ethyl-4-methyl-benzene 21 1.2660000 -2.2400000 -2.2080000 1.9310000 -1.0130000 -1.6030000 1.8850000 -1.0360000 -0.1120000 2.9210000 -1.6310000 0.6080000 2.8780000 -1.6520000 2.0020000 1.8000000 -1.0790000 2.6760000 0.7640000 -0.4840000 1.9550000 0.8070000 -0.4630000 0.5610000 1.7530000 -1.1040000 4.1660000 1.3050000 -2.2140000 -3.3030000 0.2150000 -2.2880000 -1.9070000 1.7570000 -3.1620000 -1.8770000 1.4390000 -0.1050000 -1.9730000 2.9730000 -0.9520000 -1.9400000 3.7650000 -2.0800000 0.0920000 3.6890000 -2.1180000 2.5550000 -0.0810000 -0.0360000 2.4720000 -0.0050000 0.0020000 0.0080000 2.2380000 -0.2110000 4.5790000 0.7190000 -1.1380000 4.5320000 2.2600000 -1.9910000 4.5660000