MMs02975921 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 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 -1.4999 0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2386 1.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4773 2.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0226 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 1.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1534 2.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5759 2.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5629 0.5093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1323 0.0582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7687 -0.3829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1443 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4367 -0.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5805 -2.0391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5601 0.4479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9620 1.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7233 3.1159 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4689 1.6797 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0246 0.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4757 -1.3073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9401 -1.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9535 -0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5024 0.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0379 1.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 3.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4547 5.2090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7385 1.3317 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5909 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -1.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6317 3.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7926 3.6296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5529 2.7061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6328 -1.5752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7140 1.2824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2859 -1.4640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4233 -2.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4809 -2.7406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9522 -2.2767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6840 -1.4780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0179 0.0281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6921 1.0612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5547 2.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0259 1.8739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4971 2.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7159 3.9296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3068 4.9741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 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 12 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 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 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 46 47 1 0 0 0 0 M END