PUBCHEM-ZINC06595878 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.0270 1.6190 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.1060 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -0.4450 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.8070 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -2.6910 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -4.0750 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -4.6090 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -3.7140 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -2.3080 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -1.3810 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -2.1430 -4.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -0.5080 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -0.4790 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -6.0470 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -7.0270 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -8.5800 -1.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -7.8380 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -6.5220 -2.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -8.6690 -3.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -8.8190 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -9.4150 -2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 1.9700 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 1.9460 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 2.0950 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.1930 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -0.2180 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -2.3350 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -4.7090 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -4.1540 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -2.7820 -5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -1.4460 -5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -2.7670 -4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 0.1960 -3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 0.0930 -4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.1300 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -1.0790 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 0.1150 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 0.2360 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -6.9400 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -9.6650 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -8.1880 -4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 -8.3760 -4.3290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 M CHG 1 42 -1 M END