MMs02807287 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 48 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 -0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 1.2697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7397 -1.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2398 -1.3166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4796 -2.6097 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3021 -0.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3139 0.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 1.1597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5343 1.5571 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4950 2.1571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3891 3.0501 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6095 3.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4644 5.4152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9750 3.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1201 1.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0449 -0.5566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8245 -1.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9696 -2.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3351 -3.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5555 -2.6704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4104 -1.1774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4857 1.1877 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.1954 4.1736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4158 5.0458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6682 2.3253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3682 2.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3316 -2.3722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4922 -2.4057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2674 -1.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2967 3.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2783 -1.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9933 -3.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4512 -4.7369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6479 -3.1670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3867 -0.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4620 1.8854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8998 0.9363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 45 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 28 1 0 0 0 0 20 27 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 3 0 0 0 0 M END