MMs01776870 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 58 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 1.2984 0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8965 0.7534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4945 0.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7955 -1.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4972 -2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1975 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0952 -2.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0966 -3.7420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3936 -1.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5491 0.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0160 0.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6249 1.6851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7672 -0.9842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7645 -2.0998 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9236 -2.4104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0776 -3.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0749 -4.6823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8261 -5.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2930 -5.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4485 -4.1756 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2591 -1.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1397 0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2429 -1.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5123 1.1335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4335 1.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6009 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 -0.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6009 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5262 1.6697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0689 1.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8275 -0.9176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3702 -0.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4935 1.9557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8329 0.6078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4982 -3.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1588 -2.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8814 -4.5579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3389 -7.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1855 -6.4697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9294 -2.2935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3381 -1.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0607 0.5997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4695 1.2284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1471 -1.9397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7320 -2.5465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3388 -0.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4837 0.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2167 2.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5408 1.8379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6820 2.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6316 -0.0808 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 17.8316 -0.0808 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 55 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 55 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 55 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END