PUBCHEM-ZINC06869454 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -2.7740 1.8420 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 0.8150 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.2450 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -0.4440 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -1.5780 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -2.3390 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -3.6450 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -4.2160 0.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -5.4240 -0.4410 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7550 -6.2050 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -5.7540 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -6.8970 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8390 -7.1620 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9900 -6.7590 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2180 -7.0480 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3680 -7.7050 1.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2370 -8.0800 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 -7.8390 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9750 -7.9460 -0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 -4.5880 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -4.3420 1.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -3.6740 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 -2.6570 1.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -5.2140 -1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -6.1650 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -6.0260 -4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -4.9290 -4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -3.9730 -3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1770 -4.1170 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -4.7570 -6.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -5.5510 -6.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 2.5760 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 2.3850 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 1.3660 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 1.2660 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 0.3140 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 0.0530 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 1.3240 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -0.0650 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.5270 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.2520 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -1.3710 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.1580 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -1.7170 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -2.5610 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -4.3860 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -3.4450 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9400 -6.2290 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1440 -6.7500 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3880 -8.6010 3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0930 -8.1710 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6300 -8.6680 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -7.0390 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -6.7820 -4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7550 -3.1270 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 -3.3660 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.2360 -1.0270 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.3840 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 57 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 22 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 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 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 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 30 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 30 31 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END