MMs02428411 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 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 0.9196 -1.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3535 -2.6209 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9535 -3.6602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3461 -1.2353 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1947 -2.0839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1512 -0.3287 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -0.8015 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9335 0.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1242 0.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5601 1.0928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0306 1.6855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3728 3.1460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 4.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8332 2.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9123 3.4882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8757 -1.8281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3116 -1.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6538 0.0662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4053 -2.4208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8411 -1.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1834 -0.5265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6192 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7129 -1.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3707 -2.5797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9348 -3.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4468 -3.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0284 -5.1986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5584 -1.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 0.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7357 0.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2992 4.4695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9888 5.7748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1308 4.7433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5595 1.6354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0016 2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9701 3.3879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0492 4.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 3.7620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6386 2.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6019 -2.9964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1315 -3.5892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3084 0.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8930 1.0757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8616 -0.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2456 -3.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 -4.1819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7629 -0.2582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7409 -1.6452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3539 -2.6231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8531 -2.6520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5382 -3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 -3.6282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7667 -4.5842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 52 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 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 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 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 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 54 55 1 0 0 0 0 M END