MMs01727076 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.1431 -1.4932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9808 -2.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3832 -3.8624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1099 -3.7193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4352 -2.2550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4451 -2.1613 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4589 -3.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9232 -2.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9371 -4.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4014 -3.7216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8518 -2.2908 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1624 -1.1317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2826 -2.7413 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8322 -4.1720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5254 -5.5022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0035 -1.4259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5031 -1.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2819 -2.6745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2240 -0.0771 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8240 0.9622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7237 -0.0437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5024 -1.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0020 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7229 0.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9442 1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4446 1.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2226 0.0565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7993 1.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4453 1.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1662 2.5204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7738 -2.9039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3785 -4.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 -1.1854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3737 -1.5107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4867 -5.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 -6.5832 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1945 -0.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1145 1.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1945 0.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4472 -3.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9186 -4.3752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3805 -0.4002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9257 -2.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6250 -2.3179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5209 2.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8216 2.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2803 -4.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8623 -5.3748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4767 -3.7928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1839 -1.3546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3208 -0.3118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9457 1.1716 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0224 -5.8030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 32 33 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 34 35 1 0 0 0 0 35 51 1 0 0 0 0 35 52 1 0 0 0 0 36 37 1 0 0 0 0 36 54 2 0 0 0 0 M CHG 1 37 -1 M CHG 1 53 -1 M END