3-methylpentane 20 0.3890000 -0.9600000 -0.3920000 -0.7740000 -1.8070000 -0.8890000 -0.3420000 -3.0440000 -1.7050000 0.5420000 -3.9830000 -0.8790000 -1.6010000 -3.7660000 -2.2290000 -1.3000000 -5.0090000 -3.0540000 0.0320000 -0.0980000 0.1790000 1.0330000 -1.5570000 0.2630000 1.0080000 -0.5990000 -1.2180000 -1.4100000 -1.1690000 -1.5160000 -1.3850000 -2.1160000 -0.0320000 0.2400000 -2.6980000 -2.5700000 0.8450000 -4.8570000 -1.4650000 0.0230000 -4.3360000 0.0170000 1.4480000 -3.4760000 -0.5330000 -2.2540000 -4.0400000 -1.3910000 -2.1740000 -3.0750000 -2.8610000 -2.2350000 -5.4690000 -3.3920000 -0.7590000 -5.7590000 -2.4700000 -0.7070000 -4.7600000 -3.9390000