MMs02736332 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2467 -1.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7467 -1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7533 1.2895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 1.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7533 1.2818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7467 -1.3163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2380 -1.4769 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3972 -1.7874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5462 -2.9449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2452 -3.6915 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1331 -2.6850 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8225 -3.8441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6651 -2.9931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5529 -1.9866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -2.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 -4.2013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0515 -4.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2446 -0.3647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7847 1.0631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7110 -0.6803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7175 0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1840 0.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1905 1.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6569 0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6635 2.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2036 3.4527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7371 3.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7306 2.6562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0031 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -2.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -2.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 2.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 2.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6884 -2.5770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0315 -4.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6814 -0.7935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1569 -2.2424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6488 -5.4026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0789 -1.8225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7015 1.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1699 1.5433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7316 -0.9952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2000 -0.5223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0248 -0.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8366 1.7724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0088 4.3424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3692 4.9105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5575 2.9086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END