MMs01214730 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 -1.5000 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2471 1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4941 2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7529 1.2973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2412 3.9022 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0412 3.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4883 5.1995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2353 6.5003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7647 6.4935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2647 6.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1491 7.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5746 7.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5712 5.7349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1436 5.2746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7412 3.9056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6201 5.1211 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4687 5.9696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0478 4.6608 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0511 3.1608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6256 2.6940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1653 1.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1534 6.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6855 6.8552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2187 8.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2199 9.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6878 9.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1546 7.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7532 10.8232 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5977 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1023 -1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4471 1.3068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6082 3.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9529 1.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6094 4.1556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 6.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9757 7.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7808 8.8437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 7.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5404 5.0274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2443 3.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3033 1.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8845 5.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 8.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4888 9.9827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3289 7.4167 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 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 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M END