3TP Mrv0541 02241213102D 28 30 0 0 0 0 999 V2000 2.5410 -2.8681 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7125 -3.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0994 -4.2271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1646 -3.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -3.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5771 -4.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7521 -4.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5849 -1.8062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9174 -0.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3043 -0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4803 -0.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0934 0.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1372 1.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4758 0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7564 -2.6132 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4972 -3.9300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1541 -2.3161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8312 -1.4706 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7244 -0.4786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1369 -1.1931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9219 1.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 1.5580 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1481 2.1100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9829 2.1711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.9449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1433 -3.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1071 -3.2588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1903 -2.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 17 1 1 0 0 0 1 27 1 1 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 16 1 0 0 0 0 8 15 1 0 0 0 0 8 18 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 2 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 15 26 1 1 0 0 0 15 28 1 1 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 M END