PUBCHEM-ZINC04157708 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.2590 1.4150 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.0750 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -0.9190 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.3650 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -2.8920 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -2.0430 -0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -0.6530 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 -0.0750 0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -1.0970 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -2.3330 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -3.7290 0.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4820 -4.3200 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -3.7570 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -5.1750 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 -5.7220 2.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -5.8030 0.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 -7.1810 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -7.3550 2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5390 -8.8860 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9710 -10.3440 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 -11.1640 4.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 -11.1420 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 -9.7270 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -4.3820 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -5.6390 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -6.2700 -2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -5.6580 -3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -4.4140 -3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -3.7780 -2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 1.6770 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 1.8590 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 1.8720 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -0.5420 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.9850 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -3.9600 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -0.8890 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -3.1880 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -3.3060 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 -5.3040 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7160 -7.5020 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -7.7740 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 -7.0640 3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 -6.7440 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3660 -8.2670 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 -8.4850 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 -10.4210 4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4000 -10.7340 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0250 -11.8030 3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2020 -11.5520 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -9.3330 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 -9.7080 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -6.1410 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -7.2400 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -6.1460 -4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 -3.9330 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -2.8020 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 -8.7940 2.4310 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.7960 -9.1280 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END