MMs00236835 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3155 -0.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5974 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -0.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9466 -2.1620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6647 -2.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3492 -2.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0673 -2.9992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3832 -2.5934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 -1.3605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3288 -0.1670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6739 0.9823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7371 -1.3268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4578 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9574 0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7363 -1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0156 -2.5751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 -2.6087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2359 -1.2259 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9566 0.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4562 0.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2352 -1.1586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1769 1.4388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3980 2.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6765 1.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5765 1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0524 0.5765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5765 -1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5705 1.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 -4.1407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5559 -1.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9582 -3.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6904 -4.0248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8346 1.0142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5339 1.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9395 -3.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8201 0.4747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1384 1.2758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4235 3.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7748 3.7462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3725 2.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7035 0.2728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8762 1.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6496 2.6722 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END