MMs01168379 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 -0.2924 -1.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8355 -2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7128 -1.9536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8407 -0.9647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0052 -3.4248 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9868 -4.5261 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3868 -5.5654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7196 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1908 -5.5426 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3673 -4.0530 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2158 -4.9015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6762 -3.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -1.8204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0049 -1.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2939 -1.8547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 -3.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9652 -4.0873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9453 -5.5872 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5027 -4.3496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0947 -2.9714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4004 -5.5514 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -5.3749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7876 -6.5766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -5.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4812 -5.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6577 -6.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2956 -7.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.2339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2339 1.1770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 0.2339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7468 -0.8712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0444 -3.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7378 -3.2512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6266 -1.5578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -6.3085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0753 -6.9811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6648 -1.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0207 0.1123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3409 -1.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3052 -3.9683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9269 -6.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -4.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9615 -4.8346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7161 -7.1169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1336 -7.7257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3657 -3.9452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9073 -4.6177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5908 -4.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6811 -5.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8281 -6.6083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0436 -8.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9093 -8.5326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3342 -8.2196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2772 -6.4001 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END