MMs01165543 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 56 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 1.2997 -0.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8978 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4958 -0.7444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7929 1.5067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0939 -0.7421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2454 -1.5907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 -2.2338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7195 -2.5444 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4684 -1.2447 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0684 -2.2839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4637 -0.1308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7743 1.3366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6587 2.3394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2005 1.8014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3161 0.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7423 1.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0529 2.7309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9373 3.7337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5111 3.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3955 4.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9600 -1.0866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5689 0.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8427 -2.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5991 1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0397 0.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5991 -1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5291 -1.6688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0718 -1.6675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8259 0.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3686 0.9222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1272 -1.6665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6699 -1.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 0.9231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 0.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4969 -1.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 -2.2348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1276 -3.4273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0676 -0.3753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6347 0.4612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1938 3.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1857 4.9076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1977 5.1641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5030 5.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5933 3.3792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1600 -1.0866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6656 -0.2029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0561 1.3809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4723 0.7714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8725 -3.0056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5489 -3.2696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8129 -1.5932 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M END