MMs01044955 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 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 0.7561 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2561 -1.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0122 -2.5839 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2683 -3.8865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7773 -4.0503 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4724 -5.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7749 -6.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8849 -5.2539 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8951 -6.1355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0448 -7.6280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4122 -8.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6299 -7.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4801 -5.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1127 -5.2596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5122 -2.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2683 -3.8723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2561 -1.2743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -1.2672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5122 -2.5627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0121 -2.5556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7560 -1.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2560 -1.2460 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 -0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3696 -1.7112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9701 -2.4763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0422 -0.1076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3818 -0.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -7.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0707 -8.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -9.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7238 -7.8619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4543 -5.1754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9929 -4.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6512 -0.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9171 -3.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 -3.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5950 1.0845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 1.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END