IBS-ZINC02357855 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.3390 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0360 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.6720 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.0670 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 1.4430 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 2.0790 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 2.2490 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 2.7690 -1.6060 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 3.6650 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 3.8320 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 4.5720 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1690 5.0500 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0630 4.8100 1.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2060 5.7780 0.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8760 6.1160 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3160 6.0380 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4310 5.5990 -1.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 4.8720 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 4.2880 -2.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 4.3260 -3.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9710 4.6400 -4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 5.2790 -3.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2480 5.3840 -3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 4.5810 -5.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1290 4.3410 -4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 3.2890 -5.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6880 3.4430 -6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 3.0320 -4.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 2.1310 -5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 0.9780 -6.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 5.4060 -6.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 6.5560 -4.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3800 6.7800 -1.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -0.6140 -0.1890 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6370 -0.0960 -0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -1.6920 0.3520 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9910 1.8370 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -0.6140 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -1.7470 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 3.1530 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 3.1280 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 1.6390 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 1.9060 -4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 2.4120 -6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 0.2030 -6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 5.0160 -7.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 7.1940 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0410 7.1110 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4710 6.9740 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 32 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 -1 M END