MMs02205645 MOE2007 2D CORINA 3.40 0006 02.08.2006 82 82 0 0 0 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 1.2934 -0.7597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8914 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8802 -2.2791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4894 -0.7985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8052 1.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0874 -0.8179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3808 -1.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6737 -2.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9794 -1.5990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2719 -2.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5770 -1.6206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5856 -0.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8887 0.6221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8999 2.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6214 4.3835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3281 5.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0237 4.4030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7303 5.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4255 4.4223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4143 2.9223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1098 2.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 0.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9148 3.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2082 2.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1970 1.3643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5128 3.6045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.8062 2.8449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1108 3.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4042 2.8254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.1220 5.0851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4266 5.8254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4378 7.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6077 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6077 -1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5152 -1.6731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0579 -1.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4316 0.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 0.8746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4804 -1.9985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3092 -1.7314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8519 -1.7429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9620 -2.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2006 -1.3603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8950 -3.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4371 -3.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4926 -3.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0358 -3.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9796 -2.7511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7600 -1.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2920 -0.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0718 0.8223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0799 1.9035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3206 3.2455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0402 5.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8016 4.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1063 6.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5637 6.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5085 6.0761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9659 6.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0235 5.5529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2422 4.2227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7078 3.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9265 1.9825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9184 0.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6797 -0.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6930 4.5374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1503 4.5489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5217 4.8045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0280 1.9314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5706 1.9199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.8286 4.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6099 6.0249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6378 7.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4468 8.5253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.2378 7.3343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6102 2.8837 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 81 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 81 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 18 82 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 19 82 1 0 0 0 0 20 21 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 24 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 26 81 1 0 0 0 0 27 28 1 0 0 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