MMs01317229 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 62 0 0 0 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 1.4156 0.4962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 -0.4816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -1.9556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8594 -2.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0146 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4724 1.4301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4648 -1.4010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3842 0.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5216 -0.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9372 0.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2153 1.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0778 2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6622 1.9848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5247 2.9626 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.0747 -0.9487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7966 -2.4227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4902 -0.4525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6277 -1.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0433 -0.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3214 0.5399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1808 -1.9119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5963 -1.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7338 -2.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1494 -1.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4274 -0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2900 0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8744 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8430 0.0729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9805 -0.9049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7024 -2.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8399 -3.3567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2555 -2.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5335 -1.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3960 -0.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 1.1324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1324 -0.3970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1985 -0.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 1.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3439 1.2565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4749 -1.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4693 -3.1398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2564 -3.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2992 -1.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3477 1.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3002 3.6602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6994 -2.1906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2153 -2.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9583 -3.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5114 -3.5727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0594 -2.6796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5124 1.7337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9644 0.8405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5700 -2.7759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6175 -4.5360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.1655 -3.6428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6660 -0.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6185 0.7705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 M END