MMs03715545 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 61 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 -0.7402 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0196 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6196 -1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5195 -2.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7206 -3.9027 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3206 -4.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2206 -3.9140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9803 -2.6206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9607 -5.2186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3403 -6.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4474 -7.5964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7521 -6.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4513 -5.3867 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6104 -5.6972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4634 -4.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0106 -2.8495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9282 -4.6025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2904 -5.7465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9403 -3.4953 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2509 -4.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4875 -2.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4996 -0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9644 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9765 -0.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5237 1.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0589 1.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0468 0.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4051 -3.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8579 -5.2483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0392 -5.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -6.2397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 -5.1847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2793 -3.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2989 -6.4780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0437 -0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0437 0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6652 -0.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6536 -2.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5286 -3.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7195 -2.5776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5105 -1.3867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3056 -5.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6277 -7.5498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5496 -8.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1454 -8.5725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2319 -7.9561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8961 -6.4940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4238 -2.6207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7559 -1.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1455 -1.8531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1483 -0.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3334 2.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6967 2.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 0.7302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2642 -7.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9067 -7.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3336 -5.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4172 -2.7111 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 31 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 14 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 60 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 M CHG 1 60 -1 M END