(2S)-butan-2-ol 15 0.9780000 -0.0330000 -0.2360000 1.4100000 0.6790000 -1.5110000 0.6390000 0.1880000 -2.7390000 0.8080000 -0.8860000 -2.8800000 1.0610000 0.9420000 -3.9930000 -0.7550000 0.3900000 -2.5270000 1.5420000 0.3350000 0.6270000 1.1300000 -1.1140000 -0.3110000 -0.0850000 0.1450000 -0.0460000 2.4850000 0.5240000 -1.6590000 1.2460000 1.7550000 -1.3740000 0.5070000 0.5870000 -4.8690000 0.8950000 2.0180000 -3.8840000 2.1230000 0.7730000 -4.2030000 -1.2050000 0.0670000 -3.3230000