MMs01399495 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.7461 -1.3013 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3461 -0.2620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 -1.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9923 -2.6070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0089 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2461 -1.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7461 -1.3191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7538 1.2790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2538 1.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0267 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0044 1.4733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9955 -1.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0312 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0077 -2.5981 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5077 -2.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3858 -1.3775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8137 -1.8368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8182 -3.3368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -3.8045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0343 -4.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0388 -5.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4667 -6.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3448 -4.9580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4595 -3.7471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5969 1.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4031 1.0321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -2.3521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 -2.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3569 2.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6569 2.3245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0969 -1.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1030 1.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0701 -6.4230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8409 -7.3143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5448 -4.9544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 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 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 M END