MMs00169617 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 40 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2916 2.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5931 1.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3015 -0.7457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8897 2.2628 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1912 1.5171 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1912 2.7171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3529 0.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8211 -0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4357 -1.6495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5668 1.0203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5595 2.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8665 3.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0581 1.1820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6637 2.5543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1550 2.7160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0406 1.5054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4350 0.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9438 -0.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5531 -0.8669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.8496 -0.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5329 1.3535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2867 3.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5832 4.5085 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0372 -0.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0461 2.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3055 -1.9457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1529 0.0219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2314 -1.1680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9552 3.5228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6394 3.8139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4593 -1.1265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3413 -1.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9897 0.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0148 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 2 0 0 0 0 M CHG 1 26 -1 M END