PUBCHEM-ZINC05690484 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -0.6390 -0.5360 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -0.0220 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -2.0900 1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -2.5990 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -0.0430 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 1.4190 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 1.5160 2.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 2.7840 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 3.7990 2.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 2.7740 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 3.9820 5.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 4.0130 6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 2.8380 7.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 1.6370 7.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 1.6000 5.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 2.8600 9.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 2.9070 9.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 2.9300 10.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 2.9250 10.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 2.9420 12.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 2.9370 12.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 2.9640 13.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 2.9840 14.9070 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 2.9690 13.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 2.9860 13.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 2.9540 11.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 2.9620 11.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 2.8990 9.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -1.6190 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.0790 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.2840 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 1.0690 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -0.2790 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.3300 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.5360 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -3.6630 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -2.0660 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.4970 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -0.2010 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -0.6360 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 1.7290 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 2.0670 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 4.9100 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 4.9580 7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 0.7280 7.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 0.6480 5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 2.9260 8.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 2.9100 10.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -0.5810 1.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7540 -0.2020 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 49 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 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 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 16 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 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 26 27 2 0 0 0 0 28 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END