IBS-ZINC06719936 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.5800 2.0180 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 0.5530 1.3790 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.3550 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -1.7100 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -2.5470 2.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8270 -2.5780 3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -3.9840 1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -4.1430 0.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -2.0190 2.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -1.2500 3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -0.7790 4.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 -1.0220 2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 -0.2270 4.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6930 -0.1030 4.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 -1.4210 3.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 -2.1940 2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2990 -2.3610 2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1040 -2.2090 5.1220 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0080 -3.2050 4.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5960 -1.2150 6.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -3.0830 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5580 -4.4240 5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -5.1170 6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 -4.4760 7.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -3.1450 7.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 -2.4470 6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 2.5310 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 2.7050 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 1.7390 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 0.2540 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.4940 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.2670 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.5600 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -2.3070 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 -0.4340 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 0.7770 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 -0.7030 5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 0.5250 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 0.4110 4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 -1.6630 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 -3.1750 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -3.0290 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 -2.8680 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 -4.9350 4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -6.1560 6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -5.0170 7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -2.6530 8.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 -1.4130 7.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -4.8150 2.5290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 49 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 17 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 49 -1 M END