MMs01063512 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.4999 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2611 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -1.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7387 1.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 1.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7609 -1.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2608 -1.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0220 -2.5207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2385 1.3698 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6385 2.4091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7386 1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9775 2.6495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9774 2.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2162 3.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9551 5.2732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4550 5.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2161 3.9936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4773 2.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1938 6.5915 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2607 -1.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7607 -1.1895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4995 0.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9994 0.1288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7606 -1.1638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0218 -2.4692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5218 -2.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8999 -1.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -1.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4796 -2.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5628 -2.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8921 -1.6675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0998 -1.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8628 1.7513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5202 2.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 1.7190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 2.5018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6368 -1.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9794 -2.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0163 3.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3462 6.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4161 4.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0862 1.6541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2811 1.2701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6237 0.5102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1367 -1.6225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4793 -2.3823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8906 1.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5905 1.1731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9605 -1.1535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6307 -3.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9308 -3.5264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 M END