MMs00339736 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.2557 -0.8205 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -2.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1617 -3.2593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7778 -2.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5983 -1.4552 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1983 -2.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6576 -0.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0499 1.1610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9099 -2.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4081 -2.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2793 0.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7812 -0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5909 -1.1579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4044 -2.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9025 -2.3438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7160 -3.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0313 -4.9387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5331 -5.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7197 -3.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8447 -6.1990 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6564 1.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0046 0.6564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6564 -1.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3447 -3.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8455 -3.2587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1766 -3.8111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -3.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2585 -3.7574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5547 -2.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0127 1.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3852 0.4939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9307 1.1444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6346 0.3078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6969 -0.6921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3243 0.0121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4503 -1.2761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9145 -3.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9854 -6.0807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5211 -3.8122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0965 -1.3808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0928 -1.2322 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6928 -0.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 8 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 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 41 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 41 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 42 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 41 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 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END