MMs00055288 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 39 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 -1.5000 0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2594 -1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -2.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7405 -1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7215 -3.9025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2214 -3.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9809 -2.6199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9619 -5.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4619 -5.2289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2024 -6.5334 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.2784 -3.8806 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7784 -3.8696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5189 -2.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0188 -2.5541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7783 -3.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0378 -5.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5379 -5.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7974 -6.4676 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5569 -7.7611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2974 -6.4786 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.2783 -3.8367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2673 -2.3367 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.2893 -5.3366 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.7782 -3.8257 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6076 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0923 1.0546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4594 -1.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9404 -1.3133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1139 -4.9373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8313 -5.6201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1616 -6.4012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2621 -4.0457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5925 -4.8268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9113 -1.5303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6112 -1.5105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6454 -6.1869 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 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 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END