PUBCHEM-ZINC06352192 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 41 0 0 1 0 0 0 0 0999 V2000 -1.6440 0.0040 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 0.2030 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 1.7070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -0.2740 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 0.3840 2.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 1.2890 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -0.6170 -0.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0070 -0.3500 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -0.4260 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -1.0820 -0.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.4690 -2.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 0.7130 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 2.0510 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 2.4260 -2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 1.6780 -3.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 3.6920 -2.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 4.3980 -2.8090 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0400 3.7380 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 4.9100 -4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 3.6400 -5.4860 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 2.6130 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3460 5.6820 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 5.9310 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -2.0160 -0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 0.2860 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -1.0410 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 0.6160 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 2.3150 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 1.9350 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 2.0410 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -1.3460 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -0.0990 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 0.9840 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 -0.1030 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 0.6970 -3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 2.8420 -2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 2.0200 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 4.2710 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 5.2560 -4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 5.7520 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -2.3670 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 6.2950 -2.0440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 24 41 1 0 0 0 0 M CHG 1 42 -1 M END