PUBCHEM-ZINC00702103 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.8600 2.5070 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 3.0380 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 3.7090 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 3.2110 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 2.5540 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 3.5040 4.8810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7500 2.9950 5.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 5.0160 5.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 5.5490 6.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 5.8600 7.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 6.3820 8.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 6.6000 8.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 6.2840 7.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 5.7560 6.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 5.3290 5.1510 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 3.5520 5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 2.8720 5.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 1.4570 5.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 0.7280 5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 1.4250 5.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 2.8190 5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -1.0490 5.4680 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -1.5840 4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 7.1080 9.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 7.4750 10.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 2.9820 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 1.4350 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 2.6330 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 1.9870 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 3.5350 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 4.7800 2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 3.5480 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 2.7040 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 4.2750 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 2.6990 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 1.4720 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 5.2160 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 5.6200 4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 5.7120 7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 6.6120 9.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 6.4510 7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 0.9000 5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 0.9110 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 3.3330 5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 -1.3650 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -1.1010 3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -2.6660 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 7.8720 11.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 6.6050 11.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 8.2660 10.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 3.1370 0.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 3.0870 3.4970 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0470 2.0810 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 51 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 52 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END