PUBCHEM-ZINC00698391 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 78 0 0 1 0 0 0 0 0999 V2000 2.7900 2.4670 1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 1.7460 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.3500 1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 0.1110 3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -1.2000 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -2.1640 2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -1.8920 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -0.6660 1.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -3.0130 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -1.4900 4.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.9230 5.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -2.0590 7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.9450 6.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -2.6540 5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.4940 4.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -4.2370 7.9550 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -5.1530 7.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -4.5700 8.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -3.5720 9.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -4.6830 10.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8960 -5.9050 9.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -6.5800 11.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -5.7040 12.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4480 -5.8010 13.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -4.2820 11.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -3.2300 12.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -3.8510 11.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -5.9950 12.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -5.3000 11.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -5.2620 10.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 1.2380 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 1.3130 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 0.5230 4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.5910 3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 1.4480 2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 2.2400 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 2.1750 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 3.0770 1.2750 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 1.9220 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 3.4780 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 2.5160 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 2.2910 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 1.6980 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -3.4380 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -2.6270 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -3.7850 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -2.8850 5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -1.1840 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.4880 7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -1.0780 7.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -3.4770 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -1.7310 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -2.1700 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -3.4490 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -2.7660 9.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -3.1860 8.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -5.5720 9.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -6.5920 9.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -6.5730 11.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -7.6000 11.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -2.3330 11.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -2.9840 13.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -3.6250 12.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -4.6730 10.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 -3.5830 12.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -2.9890 10.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -5.5560 13.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -7.0690 12.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 1.0570 4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 2.1780 3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -0.1470 4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -0.0270 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 1.5000 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 2.7950 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 29 30 2 0 0 0 0 31 32 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 71 1 0 0 0 0 34 35 1 0 0 0 0 34 72 1 0 0 0 0 35 36 2 0 0 0 0 35 73 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 37 74 1 0 0 0 0 M END