MMs02579603 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 -0.0039 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 3.7533 1.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7466 -1.3087 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 6.0000 -0.0154 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0038 1.4846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9961 -1.5154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2466 -1.3202 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8466 -0.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 -2.6890 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3224 -3.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7451 -3.6955 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7844 -4.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0461 -2.9489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7380 -1.4809 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8971 -1.7914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7446 -0.3687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2847 1.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2913 2.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7577 1.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7642 2.9677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2175 0.4278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3907 0.1753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2110 -0.6844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6708 -2.1121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5845 -5.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7958 -6.0717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -2.9971 0.0000 O 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 1.6560 2.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 2.3271 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 1.6440 -2.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1116 1.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9234 3.3134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4319 -4.8532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0557 -6.2641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6673 -7.2648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7912 -4.1374 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 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 30 31 1 0 0 0 0 30 42 1 0 0 0 0 30 43 1 0 0 0 0 31 44 1 0 0 0 0 32 45 1 0 0 0 0 M END