MMs01394940 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -0.0077 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2875 2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5904 1.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3028 -0.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8856 2.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1884 1.5265 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1884 2.7265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5556 2.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8600 3.6124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 1.0340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8216 -0.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4387 -1.6360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3528 0.0355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0560 1.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9438 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4876 -1.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7056 -2.3150 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.9146 -1.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4438 -0.0030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3435 -1.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4531 -0.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8820 -1.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2014 -2.7959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0918 -3.8053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6629 -3.3490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 -0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0499 2.0947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2814 3.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6403 -0.5814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -1.9433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1096 3.1852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6522 3.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4652 -0.7720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7193 2.3502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1318 1.7299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3482 -1.8162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1976 0.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7697 -0.5228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3445 -3.1609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3473 -4.9778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7752 -4.1565 0.0000 H 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 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 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END