PUBCHEM-ZINC02087571 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 4.0870 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 3.2940 2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 5.4110 1.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 5.9070 3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 6.8690 3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 7.8410 2.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 7.3440 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 6.3830 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 9.1650 2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 9.5630 3.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 10.1500 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 11.5530 1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 12.2130 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 13.5000 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 14.1280 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 13.4680 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 12.1830 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 15.5060 3.3500 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2640 16.0870 3.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 16.0590 3.5810 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.9460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 6.4340 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 5.0700 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 7.3920 4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 6.3080 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 8.1820 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 6.8170 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 5.8600 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 6.9450 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 10.0110 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 9.9870 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 11.7230 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 14.0160 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 13.9590 2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 11.6690 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M CHG 1 28 1 M CHG 1 30 -1 M END