MMs01253553 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.4929 0.1460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3657 -1.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7457 -2.4398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8586 -0.9280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7315 -2.1479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2243 -2.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8444 -0.6361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3373 -0.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2101 -1.7100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5901 -3.0758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0972 -3.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4771 -4.5877 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.7030 -1.5640 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5570 -0.0711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8489 -3.0569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1959 -1.4181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8159 -0.0522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3088 0.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1816 -1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5616 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0687 -2.6380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1168 1.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1943 -0.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1168 -1.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9889 1.2386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5362 0.2279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -0.4098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1461 0.3399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8333 0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2883 -4.0518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6537 0.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9083 1.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9864 1.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3911 0.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7238 -2.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4692 -3.6884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9864 -3.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3911 -3.7938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END