Betanidin Mrv2104 06072104222D 28 30 0 0 0 0 999 V2000 0.8838 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4358 -2.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1809 -3.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7329 -4.1608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -4.9454 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6710 -5.1169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3739 -3.7192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6879 -4.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9429 -5.4600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -4.0622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0299 -5.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7751 -6.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 -5.3869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -1.3653 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6538 -0.6979 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1387 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 0.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0668 -1.5229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0668 0.1271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1712 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5837 0.0165 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5837 -1.4124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 3 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 5 12 1 6 0 0 0 12 14 2 0 0 0 0 1 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 15 23 1 0 0 0 0 18 23 2 0 0 0 0 21 24 1 0 0 0 0 20 25 1 0 0 0 0 16 26 1 1 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 4 3 1 0 0 0 0 M CHG 2 15 1 27 -1 M END