MMs02039761 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2934 -0.7597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6092 1.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9138 2.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2072 1.4611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8914 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4894 -0.7986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4782 -2.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0874 -0.8180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6854 -0.8375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 -0.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3557 -0.7176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5964 -1.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3677 0.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6275 1.6942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1580 1.3933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8583 0.2217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7490 1.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2396 1.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8394 -0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9487 -1.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4581 -1.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3300 -0.2822 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6078 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 0.6078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6078 -1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5745 2.0883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9228 3.4207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2509 2.0533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8824 -1.9791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8030 1.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3092 -1.7315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8518 -1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6276 0.8472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1702 0.8357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1238 2.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2692 2.5284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9522 2.2261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4286 -2.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7456 -2.1187 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 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 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END