PUBCHEM-ZINC03686962 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -2.6320 1.0650 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 0.2030 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 0.3450 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -0.4550 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -1.4070 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -1.5600 -1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -0.7260 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -0.8650 -2.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.0310 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.5970 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -2.9480 -3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -4.0350 -4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -4.8030 -5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -5.8160 -5.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -6.0660 -5.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -5.3180 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -4.3140 -3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -3.4320 -2.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -3.3840 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.4820 -6.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -7.4870 -7.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -2.3000 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -3.1200 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -2.3940 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 -3.1970 -2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 1.9210 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 0.4960 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 1.4430 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 1.0720 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -0.3490 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -2.0450 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -0.1570 -4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 1.0260 -3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -0.3240 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -4.6120 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -6.8410 -5.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -5.5130 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -7.9010 -8.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -8.3050 -6.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -7.0640 -8.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -2.1580 -4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -1.2940 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -3.3230 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -4.0970 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -2.2200 -3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 -1.4090 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 -3.3260 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 -4.1750 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -2.4680 -2.2960 N 0 3 0 0 0 0 0 0 0 0 0 0 8.0110 -2.9900 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 -1.5410 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -2.3320 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 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 18 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 M CHG 1 49 1 M END