MMs00853394 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 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 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2572 -1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7572 -1.2782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7427 1.3198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7571 -1.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0143 -2.5647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2571 -1.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 -0.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5611 -0.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5695 -1.9904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1455 -2.4619 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8726 -2.7332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8810 -4.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1842 -4.9760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4790 -4.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4707 -2.7188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1675 -1.9760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1592 -0.4760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1951 0.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8560 0.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8477 1.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0067 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6629 -2.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3629 -2.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 2.3474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5941 1.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7549 1.1043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8451 -4.8389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1908 -6.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5216 -4.8130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5066 -2.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 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 M END