MMs02072871 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 49 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 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2476 -1.3031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7476 -1.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4953 -2.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9953 -2.6090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7476 -1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2476 -1.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1271 -2.5291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5545 -2.0682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9803 -2.5343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8641 -1.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9847 -0.1073 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5572 -0.5682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1315 -0.1021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4412 -3.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9078 -4.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9136 -3.1634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3688 -5.7037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8354 -6.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8412 -4.9053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3078 -5.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7687 -6.6473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7630 -7.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2964 -7.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2354 -6.9618 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0022 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0022 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2938 1.1794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6284 0.4057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -3.6444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5934 -3.6493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6019 1.0272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9019 1.0321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7542 -3.6697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0641 -1.3246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2526 -4.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3971 -5.1609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5642 -6.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4724 -3.7634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1124 -4.3296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1318 -8.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4918 -8.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END