MMs01145947 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 0.0115 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0278 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2818 -2.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2703 -3.7598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0344 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3277 -3.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6095 -1.4801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9142 -2.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2075 -1.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5122 -2.2002 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8055 -1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1102 -2.1803 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2617 -3.0289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2784 -3.6709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7480 -3.9715 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4880 -2.6668 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0880 -3.7060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4758 -1.5598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7765 -0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6541 0.9049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1995 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9786 -2.4986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8695 -3.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3600 -3.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9596 -2.1621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0687 -0.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5782 -1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0092 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7008 -1.1354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4619 -2.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4536 -3.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6721 -4.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7298 -5.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8128 -5.4132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7467 -4.8644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5078 -3.5225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3738 -0.5549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8311 -0.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1499 -3.1452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6926 -3.1334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4291 -0.5469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9718 -0.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5214 -3.4002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0785 -3.6801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1621 -4.8652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5790 -0.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3379 0.7638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8199 1.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3898 -4.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0728 -4.5025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1521 -2.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5484 0.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8654 -0.1582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3162 -2.2400 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3555 -2.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 58 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 58 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END