MMs01161209 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 1.3053 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9032 -0.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1834 1.5433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8782 2.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5855 1.5216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4762 2.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4637 3.8041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7814 1.5650 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0992 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3794 1.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0742 2.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7701 -0.3980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3701 -1.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0310 -1.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5612 -1.4036 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2605 -0.2287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8592 1.1466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1523 -1.4349 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6427 -1.2656 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.8018 -0.9550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2414 0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5345 -2.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0249 -2.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5913 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5416 -1.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0842 -1.6519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9133 -1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2402 -0.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8682 3.4824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5413 2.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6105 0.2636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 -1.0659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3356 -1.5997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8782 -1.5868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5629 1.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7804 2.7177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2952 3.2386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8378 3.2515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1313 -2.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6697 -2.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6734 -2.5352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3416 -0.3692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7203 1.2100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1411 0.5887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4604 -3.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8749 -3.6225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1603 -3.4948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2173 -2.1671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8895 -1.1102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7571 0.7083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9968 1.8841 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 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 17 57 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 57 58 1 0 0 0 0 M END