PUBCHEM-ZINC04216728 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.2550 0.9990 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.2920 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -0.7880 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 0.0060 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 1.3030 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 1.7940 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -0.5690 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -1.6680 1.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.2030 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -1.5440 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2210 -2.5190 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 -1.8450 -1.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6680 -2.9560 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0180 -2.4250 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8810 -1.6910 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8320 -0.5860 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -1.1240 0.1590 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1440 -1.8580 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -0.0320 0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2710 0.4400 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 1.0360 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4400 0.5090 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 -0.8370 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 -1.2400 -3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6590 -0.3240 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 0.9990 -4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6630 1.4160 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2390 -0.6950 -5.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 1.3860 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -0.9120 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -1.7990 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 1.9640 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 2.8030 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 0.5440 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 1.0400 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 -0.8630 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -2.0940 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 -3.2980 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -3.0320 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3220 -3.7010 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8050 -3.5140 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7170 -3.2610 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4530 -1.7550 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6030 -2.4050 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8490 -1.2640 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 -0.1450 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2130 0.2130 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 1.6070 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4560 1.7510 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7510 -2.2720 -3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4390 1.7020 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3580 2.4560 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4960 -1.6310 -5.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -0.7130 -0.2390 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9090 -1.3970 0.5260 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 9 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 54 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 54 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 54 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 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 24 25 1 0 0 0 0 24 50 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 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END