MMs01185452 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 0.4140 -1.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8695 -1.8041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2835 -3.2459 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -3.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7807 -2.5289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -5.0500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2299 -6.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0691 -7.4756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5109 -7.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5627 -5.5626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6019 -6.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 -4.7233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8578 -3.2242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2996 -2.8103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9567 -1.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4530 -1.3567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2922 -2.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6351 -3.9484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1388 -4.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2157 -5.2359 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6296 -6.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0852 -7.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4992 -8.4818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1268 -5.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1101 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6064 0.0968 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1534 0.3312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3312 1.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1534 -0.3312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7794 -1.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3307 -2.6389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9528 -0.6070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0629 -1.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4502 -4.1094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3664 -5.3991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3109 -7.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0098 -8.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -8.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7197 -8.2434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7079 -6.9775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2853 -0.4673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4892 -2.5159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3065 -4.9430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4363 -6.8035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5463 -7.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2443 -7.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.8129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8303 -9.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6526 -8.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9903 -6.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9601 -5.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2633 -5.1274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 1.2350 0.0000 O 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 2 31 1 0 0 0 0 2 32 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 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 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 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 2 0 0 0 0 M CHG 1 27 -1 M END