MMs01930326 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.9833 -1.1327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6449 -2.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9302 -3.3675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0629 -2.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4777 -1.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3812 0.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 1.5755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8699 0.0106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4551 -1.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9438 -1.5543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5516 -2.5679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1368 -3.9490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7734 1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2621 1.0242 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9516 2.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2859 2.1205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6449 1.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4611 -0.0030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9885 -0.2882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9573 2.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9845 3.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2969 4.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5821 3.6647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5550 2.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2426 1.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2154 -0.0611 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.8945 4.3911 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9062 0.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7867 0.9062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9062 -0.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -3.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0319 -4.4172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6049 -5.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2417 -3.4809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7046 1.7535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.3553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 2.8433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9046 3.1487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9563 4.3305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3186 5.6379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5832 1.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 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 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END