PUBCHEM-ZINC04576664 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0930 2.5160 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 1.8520 1.7550 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1820 1.5390 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 2.8330 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 3.0770 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 3.9780 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 4.6350 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 4.3910 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 3.4940 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 0.6290 1.7340 C 0 5 3 0 0 0 0 0 0 0 0 0 0.7960 0.2170 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 1.0370 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 1.2770 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 1.6520 3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 1.7850 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 1.5430 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 1.1650 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -0.6240 2.8760 S 0 3 3 0 0 0 0 0 0 0 0 0 -1.1480 -1.0740 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -1.4600 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -2.1050 3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -2.7440 3.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -2.7390 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -2.0950 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -1.4590 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -1.7720 3.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 2.8920 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 3.3430 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 1.7850 3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 2.5640 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 4.1680 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 5.3380 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 4.9040 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 3.3070 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 1.1730 4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 1.8400 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6890 2.0780 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 1.6470 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 0.9720 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.1590 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -0.6240 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.7120 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -2.1090 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -3.2470 4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -3.2380 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -2.0900 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -0.9590 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -1.8240 4.7590 H 0 0 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 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 2 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 10 -1 M CHG 1 18 1 M END