MMs00468071 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.1444 -0.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2675 -2.1867 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3325 -3.2259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -3.3967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5787 -2.9276 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7787 -2.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5728 -1.4276 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1049 -0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0609 -1.2389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0478 -4.3523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6231 -4.8215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9474 -6.1606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2325 -2.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9876 -0.8965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9773 -3.4945 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4773 -3.5004 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8773 -4.5397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2324 -2.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7324 -2.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4875 -0.9142 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.9875 -0.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2222 -4.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7222 -4.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4889 0.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7757 0.9155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9155 0.7757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7757 -0.9155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1877 -3.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4232 -5.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3733 -4.5314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1064 -1.7895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4455 -1.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5194 -3.3912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8584 -2.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9922 0.2799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1875 -0.9248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9828 -2.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6568 0.2147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7644 1.6582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3209 0.7658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4671 -6.0985 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 42 -1 M END