Delphinidin 3-O-xyloside Mrv2104 06072104312D 31 34 0 0 1 0 999 V2000 -0.4126 -3.7447 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8976 -4.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -5.1660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6675 -2.9600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0001 -2.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0001 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 -1.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 -0.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.0001 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 2.1435 -0.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5726 -0.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2871 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5726 -1.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 -1.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0001 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7146 -0.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4291 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1437 -0.4123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4291 0.8252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1437 1.2377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7146 1.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7146 2.0628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0001 0.8252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6673 -2.9600 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4521 -2.7051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4124 -3.7447 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8973 -4.4123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 0 2 3 1 0 0 0 0 1 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 1 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 10 17 1 0 0 0 0 17 18 2 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 19 27 1 0 0 0 0 5 28 1 0 0 0 0 28 29 1 6 0 0 0 28 30 1 0 0 0 0 1 30 1 0 0 0 0 30 31 1 6 0 0 0 M CHG 1 9 1 M END