PUBCHEM-ZINC05552004 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.8340 1.5040 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 0.1640 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.9070 1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.1640 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -2.2650 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -1.1220 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0730 -0.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -3.5550 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -3.3900 -2.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -3.3660 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -3.5340 2.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.7130 2.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.6560 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 0.6680 4.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5870 1.5000 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 0.8760 5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 1.8350 7.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 2.8690 8.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 4.2220 8.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 4.3890 6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 3.3740 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 5.2990 8.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 6.3590 7.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 7.4490 8.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 7.4930 10.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 6.4680 10.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 5.3820 10.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 8.5350 10.6400 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.7160 5.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 0.4100 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 1.4010 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 2.0810 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 2.0700 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -1.1300 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -4.2970 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -3.9320 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -4.2640 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -4.2720 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -3.2560 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -4.4070 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -0.7380 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -1.4950 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 1.1660 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -0.0270 5.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 0.8200 7.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 1.9800 7.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 2.7940 9.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 2.6130 8.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 5.3980 6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 4.2320 6.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 3.5390 5.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 3.4250 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 6.3420 6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 8.2550 8.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 6.5170 11.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 4.6080 10.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 1.9670 6.2790 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8440 1.7950 6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 29 30 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END