IBS-ZINC06660706 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 0.1190 1.3620 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.0250 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6960 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 0.0900 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 1.5030 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 2.1120 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 2.2330 -0.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 1.6340 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 0.2420 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -0.4960 -0.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -2.1600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.8590 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -4.3140 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -5.0850 0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -4.7220 0.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -3.8210 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -4.1460 0.3960 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -2.2250 0.1380 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -6.1500 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -6.5450 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -8.0140 2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -8.6770 1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.8590 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.5870 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 3.1890 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1740 2.2250 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -0.2330 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -2.6830 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -6.3520 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -6.7280 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -6.3420 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -5.9660 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -8.5860 3.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -9.5310 3.2520 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 33 34 1 0 0 0 0 M END