PUBCHEM-ZINC05795569 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 0.8120 1.6670 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 0.2660 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.2640 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.1550 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -0.6650 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.2880 3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -1.4160 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.9190 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -1.0770 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -1.4500 -1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -1.6910 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -1.4220 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -1.6840 -3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -1.5560 -5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -1.1840 -5.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -0.9200 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -1.0420 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.8630 -1.6520 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4710 -0.5160 -1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1050 -1.4300 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 0.2940 -2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 1.3610 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 2.1090 -3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 1.7840 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.7100 -3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.0360 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 0.3880 -4.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.7280 -3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 2.5160 -5.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 2.0870 -6.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 3.1600 -4.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 3.4360 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 1.7100 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 2.1090 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 2.2210 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.3290 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.5780 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -1.6730 3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -1.9000 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 -1.9740 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -1.7510 -5.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -1.0990 -6.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.6310 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 1.6140 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.8740 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -0.8760 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -1.6230 -3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -0.5370 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 1.0720 -6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 2.7560 -7.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 2.1080 -6.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 2.5690 -4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 4.2960 -4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 3.6550 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 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 12 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 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 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M CHG 1 18 1 M END