PUBCHEM-ZINC04544108 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 -0.2750 1.4620 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.0180 -0.4570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7750 -0.2150 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.0200 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -0.8630 2.2170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9090 -1.9130 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -0.7430 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -0.6420 4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -0.5680 5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -0.6190 6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -0.7290 4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -0.8160 3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -0.9360 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -1.3820 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -0.5590 1.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4390 0.5020 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.7450 -0.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1390 -0.3470 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -2.1920 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -2.0510 -1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.7710 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -0.3900 -2.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -0.5450 7.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -0.9240 8.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8880 -1.8350 8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -1.2090 9.3720 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3160 -1.9940 8.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -1.5660 10.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5600 -2.5160 10.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -0.4500 11.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7630 -0.7160 12.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.2190 10.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5150 -1.1460 10.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 0.1320 8.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 0.8210 10.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.6240 9.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 0.7330 11.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 0.8660 10.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1920 -1.7370 11.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -0.8370 11.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -0.0130 9.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 0.3010 8.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 1.9560 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 1.5900 -1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.9970 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.2330 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 0.4490 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -0.1930 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.0790 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.6170 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -0.4490 6.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 -0.7570 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0410 -1.6510 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 0.0420 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 -2.4500 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -1.2590 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.7360 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -2.7560 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -2.8940 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -1.9200 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 0.6940 11.8670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 48 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 39 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 37 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 2 0 0 0 0 35 61 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 61 -1 M END