MMs01044435 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 38 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 -0.0126 -1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2801 -2.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5854 -1.5217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3053 0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 0.7173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1834 -1.5435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4761 -2.3044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8781 -2.2826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5013 0.6955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7814 -1.5653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0992 0.6737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4644 0.0521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4774 1.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9773 1.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7382 2.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9991 3.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4992 3.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7383 2.4637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2685 2.1641 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7639 -1.4177 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9158 2.2172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0342 0.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0568 -2.0912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2701 -3.4608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3153 1.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5113 1.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5686 0.1016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9382 2.4285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6078 4.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9079 4.8006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8817 2.8259 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 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 25 35 1 0 0 0 0 M END