MMs00485291 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 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 -1.4904 0.1699 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6495 0.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7894 1.6398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4838 2.3783 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6221 1.3649 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2221 0.3257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 1.6639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 3.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0859 0.5405 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5558 0.8395 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2452 -0.3197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0318 2.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5017 2.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9777 3.9834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4476 4.2824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5497 -0.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0196 0.0150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3139 3.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0617 4.4668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5197 4.7610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5038 -0.9360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -2.0805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2598 -1.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -0.3808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9338 1.2789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2678 2.7402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7051 -0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 2.4393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0004 3.4615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 1.3613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6885 2.3835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0552 3.6871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6703 5.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9838 5.1069 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0737 -1.7065 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3498 6.2513 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1576 6.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2139 7.4436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5421 6.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M CHG 1 37 1 M END