MMs00031097 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 64 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 0.7409 -1.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0182 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7227 -3.9023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2226 -3.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9817 -2.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2408 -1.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2408 -1.3358 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8408 -2.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4817 -2.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7407 -1.3463 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9407 -1.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4816 -2.6506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7589 1.2517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7407 -1.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2406 -1.3778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2588 1.2202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7589 1.2307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4997 -0.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2588 1.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7587 1.1887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3660 2.2237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9635 -5.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0364 -5.1960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5364 -5.1855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0434 0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5927 1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 -0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2182 -2.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8752 0.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2166 1.1593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2998 1.1517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6304 0.3710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -3.8098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6064 -3.0479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4382 -3.2433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0743 -3.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0033 -2.3542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1754 -1.5686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9408 -2.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0240 -2.5581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3654 -1.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0587 2.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3893 1.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6341 1.6490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9755 2.4110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6244 -0.5129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2830 -1.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1340 1.6175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4754 2.3795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9201 -5.8097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5562 -6.2604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0069 -4.6243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -3.9855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7363 -5.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5448 -6.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9997 -0.0841 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.5997 -1.1233 0.0000 H 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 28 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 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 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 61 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 61 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END