MMs01679822 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.7539 1.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2539 1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 -1.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7461 -1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -1.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 -1.3194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6314 -0.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1722 1.3194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0566 -0.5764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0520 -2.0764 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0520 -3.2764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 -2.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1562 -3.9608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2629 -2.9618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6350 -2.3558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7963 -0.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1685 -0.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3793 -1.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2180 -2.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8459 -3.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7515 -0.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9128 0.9534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1571 2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8571 2.3296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8429 -2.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1429 -2.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2952 1.1688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6288 0.3934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1172 -1.7219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4509 -2.4973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3096 0.5966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2496 -0.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1338 -4.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8277 -0.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2975 0.9345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1867 -3.3435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7168 -4.4342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9624 -1.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0601 -0.9385 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 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 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 42 43 1 0 0 0 0 M END