MMs01161647 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.5000 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2397 -1.3168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7396 -1.3287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7602 1.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2602 1.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7395 -1.3524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2395 -1.3642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 1.2337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7601 1.2456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0203 2.5268 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5202 2.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2805 3.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5408 5.1129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7804 3.7962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5407 5.0892 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1407 6.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8010 6.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0406 5.0774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7803 3.7724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2803 3.7606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0405 5.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3008 6.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8009 6.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -2.6692 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.0511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1088 -1.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4387 -2.5002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 -2.5087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -1.7480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 1.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5611 2.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1359 1.7005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4779 2.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1313 -2.3868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3025 1.3349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6446 2.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3722 2.7522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8449 6.9859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2092 7.4381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7570 5.8024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1721 2.7380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8720 2.7166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2405 5.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9090 7.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2091 7.4144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END