MMs01673956 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 2.5980 0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 2.2586 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2840 3.4586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 2.2413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 2.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 4.4826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 2.2240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 0.7240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 0.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 2.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 2.9653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9397 2.6607 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.8133 1.4413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9235 0.2337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 3.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9524 2.4163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9486 3.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 4.8317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7249 4.5100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6069 1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0352 -0.6069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6069 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -1.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6412 -0.5757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1911 1.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7452 3.9243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7974 3.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8588 0.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -1.2346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 4.1653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0132 1.4333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2097 1.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1429 3.4202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6708 5.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 0.7586 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2940 -0.4414 0.0000 H 0 0 0 0 0 0 0 0 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 1 39 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 18 1 0 0 0 0 3 39 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END