PUBCHEM-ZINC03613486 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.4520 2.0680 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 3.1810 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 4.5780 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 5.1010 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 6.0950 0.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 7.4010 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 8.2560 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 9.5050 1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 9.9280 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 9.1020 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 7.8530 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 5.8430 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 6.7480 1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 4.3750 1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4370 3.5430 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 2.1750 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 1.4160 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 2.0060 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 3.3520 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 4.1130 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 4.4360 2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 5.3870 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 5.1090 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7750 3.9360 4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 3.1730 2.9030 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 3.7700 2.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 1.2280 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 1.9140 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 2.2030 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 3.1320 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 2.2720 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 4.0530 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 4.3290 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 5.3130 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 5.5690 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 4.2730 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 7.9750 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 10.1450 2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 10.8990 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 9.4300 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 7.2760 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 1.6790 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 0.3590 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 1.4160 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 3.8100 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 5.1550 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 6.2690 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 5.7400 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 3.4870 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 4.0210 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 3.3090 1.1680 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4590 3.3950 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 51 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END