PUBCHEM-ZINC03870015 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 51 0 0 1 0 0 0 0 0999 V2000 -1.7140 0.6450 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -0.0400 0.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6600 -1.1200 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 0.2490 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 1.0790 1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.4830 2.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -0.3850 3.7890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9140 -0.1700 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 0.6640 4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 2.0920 4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 3.0920 5.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 2.7890 6.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 4.3720 5.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 5.5340 5.8830 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7590 5.1760 6.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 6.2860 6.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 5.4210 6.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 6.1580 7.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 5.2250 7.8920 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0100 4.3460 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2100 5.8280 8.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 5.5250 9.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 6.4980 5.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 6.7280 4.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -1.7140 4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -2.4960 4.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 1.7270 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 0.4690 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 0.2680 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -1.2030 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 0.4490 5.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 0.5990 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 2.3220 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 2.2300 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 4.5810 4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 6.6110 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 7.1950 6.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 5.0470 7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 4.5500 6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 6.5790 6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 7.0070 7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 6.4660 7.3860 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2570 4.6780 9.1910 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9540 3.7020 9.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 5.2800 9.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 4.7610 9.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 6.8910 6.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2190 -1.8450 5.2330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3190 0.4730 -0.5190 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0240 1.4460 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 0.4390 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.0580 -1.0010 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 49 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 43 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 43 46 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 M CHG 1 42 -1 M CHG 1 43 1 M CHG 1 47 -1 M CHG 1 48 -1 M CHG 1 49 1 M END