MMs02959883 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.5000 0.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -1.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5084 -2.5932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -1.2869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5084 -2.5835 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1084 -1.5443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7626 -3.8850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5168 -5.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -6.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -6.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5168 -5.1913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2626 -3.8898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0084 -2.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7626 -3.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2626 -3.8704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 -2.5690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5083 -2.5641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2541 -1.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2542 -1.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 -1.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0167 -5.1670 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5167 -5.1622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -6.4685 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0039 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0039 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2878 1.1859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6263 0.4189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3508 -0.2457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7168 -5.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3743 -7.5203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6743 -7.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3168 -5.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9609 -3.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1659 -4.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1117 -3.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4541 -1.2588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0966 1.0751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5966 1.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END