MMs01278453 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 -1.3020 -0.7448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5921 1.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 2.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 2.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 3.7448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 1.4896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9061 2.2344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2021 1.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5041 2.2241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8002 1.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1022 2.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3982 1.4585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0902 -0.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0311 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6883 -0.7967 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.9001 -0.7344 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1553 -2.0365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6449 0.5676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2021 -1.4792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3648 -2.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8333 -3.2764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5781 -1.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -0.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0368 -0.6041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3068 -1.9448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6289 2.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2853 3.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1384 3.1568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6811 3.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5089 3.4240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 3.4137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4398 2.0544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0854 -1.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1649 -2.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2442 -4.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -4.4191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9315 -3.7601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5517 -2.6758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3775 -1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9658 0.1731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -0.1545 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END