PUBCHEM-ZINC05138799 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 6.4400 1.4860 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 1.1580 2.9930 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8430 0.3190 2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 2.3450 2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 2.7380 1.9730 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1640 3.7130 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 0.7680 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 1.6380 2.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -0.5790 2.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 -1.6730 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -2.8220 3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -2.6160 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -1.0760 2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0730 -0.5880 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -0.6410 4.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.0670 3.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1580 -0.7650 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 1.3430 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.0780 4.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 0.0030 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 0.0850 3.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.0160 5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -0.2650 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -0.2300 7.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 1.0780 8.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 1.3430 8.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 1.3000 6.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -0.8550 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -1.3290 0.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 0.6670 5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 1.6620 4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 2.3790 4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 2.1250 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 3.2470 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -1.9020 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 -1.4110 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -3.7980 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -2.7410 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -3.0810 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -3.1020 3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 1.3890 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 1.7230 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 2.0350 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.1610 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.8450 6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 0.4890 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -1.2370 5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -0.3560 7.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -1.0730 7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 1.9080 7.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 1.0460 9.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 2.3210 8.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 0.5930 8.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4380 6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 2.1480 6.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -0.2830 0.2750 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 28 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 18 1 0 0 0 0 16 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 M CHG 1 56 -1 M END