PUBCHEM-ZINC03871802 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.0900 2.0990 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 0.7270 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 0.5450 0.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.2660 -1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -1.6990 -1.3270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1300 -1.7860 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -2.3720 -2.6230 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6470 -1.7860 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.4750 -3.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0310 -3.0710 -4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -3.1500 -2.9840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3260 -4.1870 -2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -2.4510 -1.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -2.4220 -0.8020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6610 -3.4520 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -1.7250 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -2.3400 1.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2240 -3.4220 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -2.0760 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -2.1050 1.7020 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8440 -3.1290 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -1.7480 2.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2580 -2.5340 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -0.5550 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -0.0660 4.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 0.1580 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -1.4460 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -2.0400 0.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0930 -0.1380 1.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 0.6920 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5400 1.2390 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8410 2.4500 0.4550 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.9860 1.7270 1.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3020 3.4980 1.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -3.1490 -3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -3.7870 -3.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -3.2670 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -1.1490 -4.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -0.5930 -5.4580 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 0.8340 -5.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.9200 -5.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -3.6750 -2.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -3.9400 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 2.2150 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 2.2460 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 2.8560 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -0.0220 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -1.1110 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -2.8470 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -0.8530 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 0.2690 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 0.2260 2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1330 0.0940 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 1.4980 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 1.7280 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8380 0.4440 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -2.1340 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -3.6930 -4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -1.3460 2.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -1.6300 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9820 2.8360 -0.9470 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0480 -1.3510 -6.3910 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 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 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 59 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 59 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 34 2 0 0 0 0 32 61 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 39 41 2 0 0 0 0 39 62 1 0 0 0 0 42 43 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 61 -1 M CHG 1 62 -1 M END