PUBCHEM-ZINC06352218 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 0.3390 1.6970 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 0.1770 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.3520 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.8830 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.4100 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -3.9420 2.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9970 -4.3100 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -4.3970 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -3.7240 4.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -5.6310 3.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -6.2950 4.5770 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9790 -5.5320 5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -7.2870 5.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -6.6290 6.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -6.4820 6.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -5.8660 7.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -5.3940 8.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -5.5370 8.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -6.1520 7.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -7.0800 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -7.4070 2.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 -7.4210 4.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -8.2280 4.4530 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5290 -9.1040 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 -7.4300 3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 -8.6960 5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -8.1740 6.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -4.7240 2.4130 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 2.0910 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 2.0540 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 2.1100 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -0.1840 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.2040 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 0.0160 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 0.0350 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -2.2410 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -2.2680 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.9920 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.0300 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -6.1300 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -7.8940 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -8.0100 5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -6.8450 5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -5.7540 6.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -4.9130 8.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -5.1700 9.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -6.2570 7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -7.1520 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7440 -8.0360 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4210 -7.0710 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 -6.5530 4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -4.2370 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 -9.5260 5.6120 O 0 5 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 53 -1 M END