PUBCHEM-ZINC02780693 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.5260 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5840 -0.3700 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -0.4810 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.7630 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -1.2020 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -1.3570 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -1.0750 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -0.6410 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -0.3680 0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 -0.5560 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -1.4800 4.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -1.9270 5.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.5140 -0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -0.7060 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -0.3540 -2.7230 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -1.1760 -1.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -1.3850 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -1.9180 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -0.9250 -1.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -1.3250 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.9050 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.8700 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.8910 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -0.6420 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -1.6990 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -1.1960 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 0.0900 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -1.5960 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -0.3030 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -1.1620 6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.1130 6.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -2.8480 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -0.7140 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -1.3750 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -0.4380 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -2.1060 -3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 -2.1580 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -2.8170 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9340 -0.5170 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 -1.5520 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4100 -2.2120 -1.0140 H 0 0 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 4 1 0 0 0 0 2 14 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 25 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END