PUBCHEM-ZINC04543608 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 51 0 0 1 0 0 0 0 0999 V2000 0.4510 1.5740 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 0.0610 0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7570 -0.2210 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -0.5780 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -1.1080 -0.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -0.4510 -2.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.9140 -3.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2860 -0.8540 -3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -2.3580 -3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 0.0620 -4.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.2280 -4.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.4900 1.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.5540 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -0.1670 2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -1.1430 3.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1250 -2.0300 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -0.1430 4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -0.6670 5.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 0.3810 6.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -0.0720 7.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 0.9670 8.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 0.9530 7.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 0.0640 7.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 2.1410 8.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -1.6610 4.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.8800 5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 0.3320 5.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -1.6830 6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 1.8640 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 1.9870 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 2.0480 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -2.9970 -2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -2.4570 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.7420 -4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -0.8340 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 0.0980 3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 0.8080 4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -0.9320 6.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -1.5800 5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 0.5860 5.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 1.3270 6.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -0.2750 8.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -0.9890 7.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 1.7320 8.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 1.9780 9.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 2.2640 8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 3.0540 8.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -2.6610 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -2.1970 7.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -1.0160 6.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -2.4190 5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.4030 -5.5450 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 12 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 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 52 -1 M END