MMs03139468 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 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 1.3179 -2.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6232 -2.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9159 -2.2171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 -0.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2212 -2.9562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2338 -4.4561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5139 -2.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8192 -2.9343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1119 -2.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0993 -0.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5013 -0.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6972 -0.6516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0624 -0.0300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0754 -1.1363 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6754 -0.0970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5452 -1.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7145 -2.9262 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.2128 -2.8547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4698 -4.2222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3494 -3.5478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3364 -2.4416 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7364 -3.4808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8666 -2.1420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5912 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 0.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5912 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1344 -2.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8596 -3.9037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4023 -3.8908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -0.9156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 0.4139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3616 0.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8189 0.9346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8293 -4.1343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1561 -2.7647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7839 1.2655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4570 -0.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3818 1.2874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6606 -0.2413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7452 -1.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9581 -4.5819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3846 -4.2613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3053 -0.7390 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2661 -1.3390 0.0000 H 0 0 0 0 0 0 0 0 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 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 48 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END