MMs00218846 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2552 -1.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5104 -2.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2656 -3.8881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7656 -3.8820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5104 -2.5800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7552 -1.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0104 -2.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7656 -3.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0208 -5.1720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -6.4680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5208 -5.1780 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1802 -7.5097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2656 -3.8640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0104 -2.5619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2551 -1.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2447 1.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4895 2.6402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9895 2.6342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2447 1.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5103 -2.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2551 -1.2539 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2656 -3.8519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7655 -3.8459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5208 -5.1419 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1208 -4.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0132 -5.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3309 -6.7587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0349 -7.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9162 -6.5147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0048 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2869 1.1869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 0.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3104 -2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6698 -4.9297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -0.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6062 -1.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0619 -5.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3948 -4.2699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 -2.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3328 -0.4983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8020 -0.4763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4447 1.3490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0853 3.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0447 1.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6697 -4.8936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5524 -2.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8915 -3.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0083 -4.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2061 -5.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4707 -6.3833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8234 -7.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7441 -8.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1463 -8.3204 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 37 1 0 0 0 0 2 38 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 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 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 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END