MMs01452795 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 -0.9464 -1.1637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5612 -2.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8209 -3.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0587 -4.9088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4602 -5.4434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6239 -4.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3862 -3.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9847 -2.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4442 -1.0821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2585 0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5747 1.5127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7566 0.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4404 -1.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9385 -1.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7528 -0.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0691 1.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5710 1.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2509 -0.1239 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.6979 -6.9245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0994 -7.4591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -3.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0057 -2.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7742 -0.7304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -2.7528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5727 -1.8113 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7804 -0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 0.6095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1366 0.0447 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8666 1.3551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6363 0.0154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0289 -1.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8558 -3.2843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -0.7571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7571 0.9310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 0.7571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1277 -5.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7451 -4.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3172 -2.2589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7889 -2.2406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4855 -2.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7205 2.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0239 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5271 -6.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2206 -7.8868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6717 -8.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2178 -4.1812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -3.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4976 -3.3457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -1.2744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9486 0.3274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7536 1.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3126 1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1111 -2.0458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2282 -1.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2666 -3.3976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0823 -4.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -3.1711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 26 33 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END