PUBCHEM-ZINC05974170 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.2110 1.1820 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.1390 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -0.5680 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 0.3280 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 1.6500 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 2.0950 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.4710 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 4.4550 -1.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 4.3490 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 5.6080 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 6.8820 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 7.8520 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 7.5180 -2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 6.2290 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 5.2640 -2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 3.9540 -1.8890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 9.2150 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 10.2420 -2.3740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2160 10.0900 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 11.1970 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -1.8700 0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -2.6110 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -3.3890 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 -4.1890 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -4.2320 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -3.4600 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -2.6590 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -5.0740 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 -5.9050 -1.7250 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1720 -5.9790 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 -6.5020 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 1.5040 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -0.8270 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 0.0120 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 2.3130 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 7.1130 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 8.2570 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 5.9750 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -3.3700 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -4.7940 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -3.4640 -2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -2.0810 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 9.3850 -3.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 8.5840 -3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 10.3030 -3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -4.9860 0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 -4.3220 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 -5.5490 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 18 1 M CHG 1 29 1 M END