MMs01047758 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 66 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 0.8767 -1.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2611 -2.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1378 -3.8020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6302 -3.6513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2459 -2.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3691 -1.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9848 0.3014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4772 0.4522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4764 -0.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8492 -0.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6984 1.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2325 1.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7748 3.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 4.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 3.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7067 2.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1451 -0.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4472 -0.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7432 -0.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7371 -2.3280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0453 -0.0833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3413 -0.8385 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3413 0.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3351 -2.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6311 -3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9332 -2.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9393 -0.8491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6433 -0.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6494 1.4062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9515 2.1509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2475 1.3956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2414 -0.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9737 0.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7014 0.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9737 -0.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9329 -2.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6452 -4.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3316 -4.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4398 -2.1629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8217 0.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0734 1.4982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2221 -1.8394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 3.4309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4168 5.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0555 4.8579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8794 2.2867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3701 -1.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9127 -1.7398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6796 0.8497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2223 0.8434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0502 1.1167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1542 -2.1253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9201 -3.4645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8560 -4.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3987 -4.0162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3390 -3.4784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1158 -2.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6127 2.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9564 3.3509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2892 1.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2782 -0.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 M END