MMs01080254 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.3346 -0.6846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5652 -2.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0461 -2.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7308 -1.0709 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -0.0073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7234 -3.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2212 -3.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8985 -5.1649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0781 -6.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5804 -6.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -4.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4053 -4.9170 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0416 -2.5707 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5017 -3.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8859 -4.6745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9462 -2.8324 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0097 -3.8901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4906 -3.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1752 -4.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1175 -6.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7791 -5.3723 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5097 -7.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9596 -7.8817 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1187 -8.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0174 -6.8181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6252 -5.3703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3518 -9.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 -10.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8018 -9.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2941 -10.3931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1679 -2.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3475 -1.0573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6656 -2.2304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5477 1.0677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0677 0.5477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5477 -1.0677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0967 -5.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6199 -7.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -7.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2536 -1.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3145 -7.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4084 -8.6931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7084 -7.7992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1036 -6.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7265 -4.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8203 -5.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9023 -10.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0578 -11.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5858 -11.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1092 -8.5538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9617 -10.0212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4944 -10.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1449 -11.2393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4479 -11.2439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4432 -9.5469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2075 -1.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -3.2350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 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 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 41 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 M END