PUBCHEM-ZINC06471094 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 2.1770 1.3060 -1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 0.2220 -1.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3390 0.6810 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.3180 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -1.0970 0.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.8680 -2.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -1.6520 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -2.7370 -3.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3630 -4.0500 -2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -5.1250 -3.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -4.0000 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -2.9460 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -1.5740 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -2.2750 -4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -2.4010 -4.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -1.5960 -5.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -1.3710 -7.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.7600 -8.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -1.3860 -8.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -0.3660 -9.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 0.7990 -9.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 0.5560 -8.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -0.4280 -10.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -1.7110 -10.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -2.9500 -10.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -2.7350 -9.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -3.6610 -8.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 0.9230 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 1.6830 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 2.1520 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -2.9410 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -3.7920 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -4.9830 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -2.9000 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -3.2390 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.8380 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -1.2680 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.6410 -5.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.2310 -5.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -2.3250 -7.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.7320 -6.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -0.4620 -11.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 0.4500 -10.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -1.8940 -11.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -1.5550 -9.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -3.2110 -11.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -3.7990 -10.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 0.0970 0.3370 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 48 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 48 -1 M END