MMs03001381 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 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 -0.0039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4933 -2.6020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7466 -1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7466 -1.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9932 -2.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4933 -2.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2466 -1.3204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9932 -2.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4932 -2.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2466 -1.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7466 -1.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4932 -2.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7399 -3.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2399 -3.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4865 -5.2311 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0350 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.9999 -0.0389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7533 1.2660 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0031 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0031 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 1.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6027 1.0221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5906 -3.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8906 -3.6474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3905 -3.6591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6493 -0.2874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6932 -2.6361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4865 -5.2233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0838 -6.2641 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END