MMs02218946 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 -1.5000 0.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2416 1.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4834 2.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0166 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2583 1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0166 2.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5165 2.5692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3904 1.3501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8199 1.8045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7862 1.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8295 3.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4059 3.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1035 5.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6799 5.7189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2246 6.2428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9826 7.4182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6482 5.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9506 4.3010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7693 6.7668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7416 1.3230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4833 2.6268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0384 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3999 -1.0009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7416 1.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2415 1.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9832 2.6556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2249 3.9498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7582 -1.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0165 -2.5597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5933 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1066 -1.0258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0767 3.6507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6232 3.6334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 0.1042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3832 0.8670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8916 2.9965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2325 3.7593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0123 0.2112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9082 6.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5273 7.9421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9066 -1.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6113 1.7454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9424 2.5253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0407 0.1687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3718 0.9486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4832 2.6652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2581 -1.2463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8648 -2.2816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0765 3.7082 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 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 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END