PUBCHEM-ZINC02850412 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 7.3880 0.9740 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1770 0.6110 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -0.2820 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -0.8430 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -0.4660 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 0.4430 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -0.9820 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -2.2700 -3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -2.0770 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -1.7430 -0.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -2.2860 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -2.3420 1.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -2.8680 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -2.0510 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -2.6110 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -3.9790 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -4.7810 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -4.2300 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -6.5240 1.7140 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -6.9880 2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.7190 2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -7.1540 0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -6.9730 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -7.6060 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -7.4050 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -6.5820 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -5.9610 -2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -6.1480 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -5.4830 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -5.8260 -1.2240 O 0 5 0 0 0 0 0 0 0 0 0 0 8.1800 1.6730 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 1.0250 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 -0.5020 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 0.7400 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -0.2140 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -1.1650 -4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -2.5510 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -3.0860 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -1.2680 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -3.0000 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -0.9870 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -1.9880 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -4.4130 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -4.8480 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.7160 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -8.2570 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -7.8930 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -6.4310 -3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -5.3290 -3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -4.6490 -3.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 2 0 0 0 0 M CHG 1 30 -1 M END