MMs03211006 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 31 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 -0.7560 1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 1.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2439 -1.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -1.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 1.2746 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8560 2.3139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 2.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2681 3.8727 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6729 4.9147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7560 1.2677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7439 -1.3304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7439 -1.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2438 -1.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1609 2.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 2.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8391 -2.3515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1391 -2.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2861 -1.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6257 -0.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5892 1.8101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5964 3.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3608 2.3041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7970 1.1409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1294 0.3634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9878 -2.6399 0.0000 O 0 5 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 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 5 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 M CHG 1 31 -1 M END