MMs02049507 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 1.2986 0.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2977 2.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0017 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3003 2.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 0.7492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9687 0.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9718 -0.5075 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2824 0.6516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -1.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -1.4934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6387 -2.4964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4637 -0.3516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3446 -1.5656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7337 -2.9356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8365 -1.4097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7175 -2.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2094 -2.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9393 0.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4474 -0.0397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3121 -0.9419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1931 -2.1559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6850 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.3898 -2.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0026 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 5.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5955 4.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5963 3.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0007 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3382 0.1514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3399 2.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3693 1.6474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 1.3126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -2.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8496 -2.9471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9524 0.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6386 -3.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0476 -3.7774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1250 -3.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3736 -2.7588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6092 1.2699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0181 0.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2832 0.2513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5318 1.1573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3910 -0.4165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9820 0.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1143 -2.6813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5232 -3.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5241 6.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0668 6.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0052 5.6294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7774 4.2938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8203 -1.0978 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.4203 -0.0586 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 54 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END