PUBCHEM-ZINC00713330 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 0.0080 1.9430 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 1.4520 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 0.6360 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 0.3070 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 0.8000 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 1.6170 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -0.5160 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -0.0150 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -1.0390 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -1.5980 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -1.3310 0.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -2.2790 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 -1.6250 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -0.0930 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -0.7470 2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6450 -0.5090 3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4370 -0.7390 5.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 -2.0220 5.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8230 -2.2310 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 1.3390 -0.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 1.9200 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3120 1.3220 -0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 3.4040 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3610 4.0510 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 5.4440 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 6.1910 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 5.5500 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 4.1550 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 2.5770 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 1.7040 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 0.2620 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 0.5510 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 1.9960 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -1.5890 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 -3.1330 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7470 -2.6590 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5540 -2.3630 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1130 -0.7870 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6050 0.7880 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 0.1910 3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -0.0160 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 -1.5670 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7860 0.5410 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5060 -1.0970 3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.7280 5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7730 0.0160 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 1.9480 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1620 3.4760 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 5.9500 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 7.2760 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 6.1410 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 3.6860 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4280 -1.0670 2.9470 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1620 -1.8590 3.5700 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 20 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 15 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 53 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END