PUBCHEM-ZINC00424558 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.8990 -0.4570 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.0050 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -0.4590 0.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2890 0.0660 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -1.9770 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -2.4720 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -2.0870 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -0.5870 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 1.3960 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 1.6620 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 3.1350 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 3.4330 -4.9060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 3.7760 -5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 3.7630 -4.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 4.1490 -6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 4.5410 -7.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 4.8800 -8.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 4.8100 -9.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 4.4300 -8.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 4.1110 -7.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 3.7190 -7.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 3.7010 -7.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 3.3710 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 2.9070 -5.4780 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -0.0930 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -1.5470 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.0620 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.3800 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 1.0860 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -2.5170 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -2.2360 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -3.5610 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -2.0440 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -2.6110 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -2.4130 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -0.3640 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 -0.0330 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.7300 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 1.9190 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 1.0150 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 1.4240 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 3.7730 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 3.3970 -3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 4.5860 -6.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 5.1920 -8.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 5.0640 -10.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -0.0980 -1.3380 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.5970 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 47 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END