IFLAB-ZINC02702296 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 0.1940 1.4480 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.0400 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.5090 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.8760 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -2.8110 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -2.3350 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -0.9620 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.4930 -2.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -1.1650 -3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -2.3410 -4.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.6790 -5.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -3.6670 -5.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -1.6570 -6.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -1.6890 -7.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -2.8220 -8.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.8520 -9.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -4.2050 -10.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -4.9380 -8.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -4.1210 -7.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.2690 -5.2180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -4.2950 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -5.0820 -0.3380 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1700 1.7760 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.7180 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 2.0010 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.1880 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.2180 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -3.0760 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 0.4720 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -0.8060 -7.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -1.9870 -10.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -4.5940 -11.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -5.9940 -8.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.6440 1.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 2 0 0 0 0 M CHG 1 22 -1 M END