PUBCHEM-ZINC05554756 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 0.4270 2.0770 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 0.5670 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.0340 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.5530 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -2.1560 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.2840 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -2.8250 4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -3.2430 4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -3.1110 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -2.5690 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -3.8380 5.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7740 -3.5940 6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -5.3580 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -5.9220 6.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -7.9120 7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -9.4180 7.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -9.7310 6.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -8.2280 6.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -11.6480 7.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -12.5930 8.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6660 -12.3810 7.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -14.0410 7.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -14.7230 6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -16.0480 6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 -16.7050 7.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 -16.0400 8.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -14.7150 8.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -12.3500 9.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -12.7670 9.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -3.2610 6.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 2.3480 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 2.4850 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 2.5540 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 0.3300 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 0.1250 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 0.2140 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 0.4200 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -1.8070 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -2.0110 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.9590 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -2.9150 5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -3.4270 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -2.4660 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -5.8100 5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -5.6120 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -5.4800 7.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -5.7470 7.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -7.6780 8.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3450 -7.3570 7.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -9.5970 6.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 -9.7350 8.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -10.2590 6.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -9.9370 5.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -7.9080 6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -7.9990 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 -11.8790 8.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -11.8720 6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -14.2310 5.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -16.5700 5.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 -17.7370 7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -16.5540 9.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -14.2100 9.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -12.2040 9.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -13.8400 9.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -12.5580 10.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -2.3200 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -7.4180 6.8240 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7900 -7.6020 5.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -10.1990 7.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 67 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 67 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 69 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 17 69 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 67 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 69 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 25 26 2 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 66 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END