MMs00029107 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 62 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 -0.7480 1.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 2.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 1.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 1.2933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -1.3048 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -1.3094 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3480 -0.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1358 -2.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 -3.6842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5492 -2.9362 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5492 -4.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2395 -1.4685 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5501 -0.3094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5397 -0.7205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6529 -1.7259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0407 -3.0953 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1998 -2.7847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7887 -4.3955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2802 -4.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5899 -6.0222 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2897 -6.7702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1765 -5.7648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2856 -3.4414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7524 -3.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7578 -2.6423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2245 -2.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6859 -4.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6805 -5.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2137 -5.1828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1526 -4.6978 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7606 -6.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2526 -5.9146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.5668 -4.4478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2689 -3.6959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 3.8983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 5.1984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6016 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 1.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1056 3.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0984 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3536 2.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6016 1.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0975 -2.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -3.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3597 -0.7561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6912 -2.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3887 -1.5005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0289 -2.0659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0495 -6.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4094 -6.0733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1590 -7.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6638 -3.9614 0.0000 H 0 0 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 42 1 0 0 0 0 2 3 2 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 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 47 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 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 56 1 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 57 1 0 0 0 0 40 41 3 0 0 0 0 M END