PUBCHEM-ZINC06019738 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -0.9470 1.9990 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 0.1890 -3.8740 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -0.3360 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -1.8650 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -2.3080 -0.8730 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1950 -1.8370 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -3.8060 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -4.5010 -0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -4.3740 -1.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -3.8160 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -5.8330 -1.5490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1820 -6.2760 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -6.2300 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 -5.8570 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -5.4200 0.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -6.3280 -2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -5.5400 -3.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -7.6470 -2.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -8.2770 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -8.1290 -4.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9730 -7.5100 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -9.5810 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -9.6430 -2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -9.8170 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -9.8740 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -9.7580 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -9.5850 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -9.5320 -2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -8.0500 -5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -7.6330 -5.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -8.4440 -6.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 2.4300 -4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 2.3390 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 2.3150 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 0.0380 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 0.0620 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -2.2390 -3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.2630 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -5.7080 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -7.3060 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -10.1830 -3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -9.9680 -4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -9.9070 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -10.0090 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -9.8010 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -9.4940 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -9.4010 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -8.7780 -6.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 -8.3930 -7.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -2.1300 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 -6.0100 -0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -1.9060 0.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -2.3300 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 -5.7570 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 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 7 1 0 0 0 0 5 52 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 51 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 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 50 52 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END