MMs01762340 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2449 -1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4897 -2.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7551 -1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2551 -1.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -0.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5604 -0.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5663 -2.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1416 -2.5002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7833 -2.9079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1512 -2.2924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4532 -3.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6159 -4.5284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5639 -2.0292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9484 -0.6613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6933 0.6407 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4573 -0.8240 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0324 -2.3352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0317 -1.2166 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6317 -2.2558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5241 -1.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1288 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0101 1.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7140 0.2494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7448 -1.3138 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5959 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1041 1.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0856 -3.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6144 -3.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7567 1.0666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5284 0.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6626 -4.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5873 -3.4496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0526 -2.9671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2792 -2.5422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6668 -1.7338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1703 -0.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8303 0.9788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8987 1.8110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3009 1.9726 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 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 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END