MMs00968745 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 0.0080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2431 1.3110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7568 -1.2632 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2568 -1.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0137 -2.5502 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8137 -2.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2706 -3.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0275 -5.1483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5275 -5.1403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2705 -3.8373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5137 -2.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7705 -3.8293 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7626 -2.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7785 -5.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2705 -3.8213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1457 -2.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5748 -3.0591 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5418 -2.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5827 -4.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1586 -5.0302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4862 2.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0138 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7707 3.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0276 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4724 5.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2293 3.9090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0064 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0064 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2979 -1.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6298 -0.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5284 2.4996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8685 1.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3745 -0.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7146 -1.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7853 1.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1253 0.4483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1623 -2.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3473 -3.0868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3555 -4.6294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9020 -5.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2421 -6.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3254 -6.3231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6573 -5.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 -1.3616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6391 -2.1258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7688 -1.4639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5573 -5.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6083 1.5556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9707 3.8867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6331 6.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0668 6.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 3.9154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 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 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 M END