MMs01421494 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4162 0.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6962 1.9680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1124 2.4623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2486 1.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5524 -0.4850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2836 -0.7123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3763 0.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7366 1.6721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 2.7241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8499 0.0353 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8292 1.1715 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4292 2.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3349 2.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3029 0.8915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7972 -0.5247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2822 2.0277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7558 1.7477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2502 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7238 0.0515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7031 1.1878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2088 2.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7351 2.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1767 0.9078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6711 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1560 2.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3955 1.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -0.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3955 -1.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7872 2.7514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3364 3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 -1.6639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4679 2.9832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9394 3.7207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2019 2.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8867 3.1607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4667 -0.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1193 -1.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9922 3.5129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3396 4.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0650 1.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9395 2.9529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2471 2.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END