MMs03639588 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.7577 1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2577 1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2422 -1.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7422 -1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2422 -1.3303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7421 -1.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4844 -2.6428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8782 -3.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9843 -2.6517 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3843 -3.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7266 -3.9552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9689 -5.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7111 -6.5532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2111 -6.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9688 -5.2676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2266 -3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7421 -1.3572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.7813 -1.9572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7510 0.1428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0456 -0.6149 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.3562 0.5442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5455 -0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3033 0.6707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1639 2.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8639 2.3212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -2.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1361 -2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2986 1.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 0.3769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7689 -5.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1049 -7.5889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8049 -7.6050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1688 -5.2748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8327 -2.9285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5705 0.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1682 1.2680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2878 -1.9274 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 42 -1 M END