MMs02491585 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 68 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 1.4999 0.0129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2387 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7387 1.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 2.6367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7163 3.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2164 3.9163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4776 2.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0224 2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4552 5.2089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0448 5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9774 2.6497 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3774 3.6889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7162 3.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 5.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6938 6.5531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1938 6.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9549 5.2735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2161 3.9680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9773 2.6755 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5773 3.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2385 1.3700 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3976 1.0595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7386 1.3571 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5795 1.0465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2873 -0.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8648 -0.5492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5084 -0.9446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7143 -0.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4772 2.6884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2384 1.3959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7383 1.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4771 2.7143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9771 2.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7382 1.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9994 0.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4995 0.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7606 -1.1633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6450 7.9965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4239 8.8677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 7.9756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3476 0.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3073 4.9736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6134 1.5536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0551 6.3959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2447 5.1856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0344 3.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7551 5.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1549 5.2838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8063 0.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3232 -1.0865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8682 3.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5681 3.7715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9382 1.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9085 -0.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1696 -2.2077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9606 -1.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2191 9.7664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6133 9.7525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 36 37 2 0 0 0 0 36 58 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 38 59 1 0 0 0 0 39 60 1 0 0 0 0 39 61 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 41 62 1 0 0 0 0 41 63 1 0 0 0 0 M END