PUBCHEM-ZINC06031868 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.4060 1.5950 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 0.0890 0.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1360 -0.4170 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -0.3680 1.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5550 0.1770 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -0.0540 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -0.1070 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -0.3780 6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -1.7510 6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -2.5310 7.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -2.3210 8.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -3.3360 9.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -4.5430 8.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -4.7750 7.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -3.7510 6.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -3.7070 5.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -4.4720 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -2.4940 4.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -2.0710 3.7010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0870 -2.5280 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -2.3890 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -1.8800 1.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0570 -2.4030 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -2.2390 -0.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5760 -3.3330 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -1.6260 -1.3210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1890 -2.1120 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -0.2310 -1.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -1.8470 -2.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.8030 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -0.7420 0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -2.7860 -0.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -2.4650 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 2.1450 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 1.8850 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 1.9200 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 1.0240 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -0.5380 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -0.6570 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.9640 5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 0.3480 6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.2360 7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -1.3850 8.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -3.1800 10.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -5.3190 8.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -5.7190 6.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -1.9440 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -3.4730 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -1.4500 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -3.3060 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 -1.5740 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -2.3200 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.5550 3.7500 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6220 -0.1270 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END