PUBCHEM-ZINC03738158 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 1.7310 1.3770 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -0.0250 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -0.3340 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -0.4730 1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -2.2530 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.6490 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -2.0820 3.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -2.5620 4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -2.2480 5.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -2.6910 6.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -3.4590 7.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -3.7470 5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -3.3020 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -3.9340 8.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6940 -3.7280 9.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -5.3910 8.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -5.9480 9.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 -7.3570 9.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 -8.4420 9.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -9.7540 9.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -9.9830 8.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -8.9210 7.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -7.6210 8.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -6.4100 7.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -6.3090 7.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -10.7140 9.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -12.0750 9.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -12.9500 10.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 -5.1110 9.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -3.7040 10.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 1.3520 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 1.8680 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 2.0000 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.0270 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -0.5990 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.9600 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 0.7100 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 0.1500 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -0.1500 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -1.5060 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -2.5600 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -2.7040 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -3.7440 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -2.2590 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -1.6630 5.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -2.4330 7.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -4.3350 6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -3.5500 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -8.2700 10.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -10.9890 8.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -9.1110 7.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -12.3360 9.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -12.2420 8.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -14.0080 9.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 -12.6980 9.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -12.7900 11.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 -5.5780 10.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 -5.0330 9.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -3.7110 10.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 -3.0100 10.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.7350 0.8850 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4760 -0.4540 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -3.1410 8.9620 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4150 -3.1030 8.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -2.1720 9.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 61 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 63 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 63 1 0 0 0 0 61 62 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 M CHG 1 61 1 M CHG 1 63 1 M END