MMs02497544 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 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 1.2979 0.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8959 0.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1985 -1.4920 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1985 -2.6920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 -2.2399 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5379 -2.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7965 -1.4879 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 0.0121 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 1.2121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 0.7600 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4548 1.3600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 2.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7896 3.0121 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.0921 0.7641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1323 0.1657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0967 -2.2359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 -3.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -3.7399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5411 -4.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 -2.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -3.7440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8646 -4.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6016 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0383 -0.6016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6016 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5251 1.6701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0678 1.6725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8282 -0.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9845 -0.4550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1232 1.6741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6659 1.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8358 -0.8879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3103 2.0498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0795 3.3870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6945 -1.6805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7191 -2.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0080 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1569 -0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 15 -1 M CHG 1 39 1 M END