PUBCHEM-ZINC06468789 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 1.6200 2.1990 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 1.2500 -0.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3540 1.8510 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.3400 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 0.3500 1.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 0.4540 -1.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0770 -2.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9260 -0.2710 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -1.4410 -2.9560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4050 -2.1730 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -1.8630 -3.9900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5940 -1.9780 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.8950 -5.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 0.3830 -4.5410 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2360 0.2200 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 0.9690 -3.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8440 1.8220 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.5080 -3.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 1.4550 -3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 1.2980 -5.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 0.6830 -6.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -0.2460 -6.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -3.1230 -4.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -1.4750 -3.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.2420 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -1.7680 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -2.0770 -1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -1.7210 -2.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 1.6500 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 2.8420 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 2.8360 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 2.2770 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.4360 -6.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -3.3890 -5.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -0.3710 -5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -1.0740 -4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -2.1260 -5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -1.9400 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -0.2810 0.5710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 38 1 0 0 0 0 M CHG 1 39 -1 M END