MMs01353037 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 63 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 1.4947 0.1261 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8947 -0.9131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3512 -1.1053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8459 -0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4841 0.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6275 1.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 2.8048 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9507 2.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9199 0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2032 0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1724 -1.4639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5174 0.7589 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5441 0.1377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5483 2.2586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2649 3.0352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8624 2.9817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1149 0.7055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3983 -0.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7125 0.6521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7433 2.1518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4600 2.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9958 -0.1245 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.7724 1.1589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2193 -1.4078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2792 -0.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2483 -2.4007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5317 -3.1773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8458 -2.4541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8767 -0.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5933 -0.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6242 1.3218 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 18.9384 2.0449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3408 2.0983 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1328 1.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1009 1.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1958 -0.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1009 -1.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2621 -1.6091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6582 -2.2654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7376 -2.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0041 -1.2934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1102 3.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6525 3.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6814 -0.4135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9377 0.9381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6082 -0.9743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1506 -1.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9205 1.9191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1768 3.2707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2501 3.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7077 3.8632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1970 -2.9792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5070 -4.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8725 -3.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9280 -0.3759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9747 1.7978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2411 2.6787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1458 2.2052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 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 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 M CHG 1 32 1 M CHG 1 34 -1 M END