MMs03542727 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 -1.5000 -0.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2505 1.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5009 2.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7495 1.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2514 3.8963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7514 3.8958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9514 3.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2502 5.2110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1125 6.1885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4446 5.8848 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 7.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3803 8.1226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5007 7.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8135 5.7489 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5029 4.5898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8436 4.8060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2512 6.2495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3167 5.0905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3506 4.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3069 2.6765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3585 1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9918 1.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8491 2.4037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4466 1.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3114 0.4068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2427 2.5977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6004 -1.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0996 -1.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4505 1.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5987 3.6375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9495 1.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1239 4.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4602 5.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9363 6.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5679 8.4609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6796 9.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2773 8.9197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2282 8.0513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0086 6.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6589 6.2406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9501 5.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5049 3.7615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4694 2.9744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9163 1.6427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4387 1.1488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1854 0.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4581 0.3435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0271 0.7355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7684 3.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2516 3.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3279 1.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 53 1 0 0 0 0 M END