MMs00174825 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2435 -1.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -2.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7565 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2565 -1.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2564 -1.2728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2434 1.3252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7434 1.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4869 2.6355 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0869 1.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9779 2.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2825 4.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9797 5.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 4.0027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7435 -1.3177 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -2.8177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 0.1822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2434 -1.3252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9870 -2.6280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4869 -2.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2304 -3.9383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -5.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 -5.2260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2305 -3.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1052 1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0818 -3.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6182 -3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -2.4706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3861 -1.6926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8703 0.4198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2024 1.1978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6383 2.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 0.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8731 0.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9839 1.5997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1720 2.6802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4256 3.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7651 5.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6802 5.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0839 5.8105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8486 -0.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5870 -1.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2845 -1.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6166 -2.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1535 -3.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1458 -4.7142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5995 -5.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2597 -6.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1765 -6.4088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8443 -5.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3151 -3.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3074 -4.6900 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 19 1 0 0 0 0 4 5 2 0 0 0 0 4 31 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 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 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 37 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 15 1 0 0 0 0 13 18 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 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END