PUBCHEM-ZINC05569236 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.7270 -3.5270 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -2.7640 -4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -3.7180 -5.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -4.7790 -6.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -5.4950 -7.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -5.1430 -7.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -4.0820 -7.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -3.3550 -6.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -2.2600 -5.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -1.8420 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -0.8370 -3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -0.0070 -3.2020 P 0 0 3 0 0 0 0 0 0 0 0 0 -3.9550 -1.2840 -2.7290 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 0.9700 -4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 1.2190 -5.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 1.9640 -6.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 2.4590 -6.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 2.2100 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 1.4610 -4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 1.0090 -1.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 1.8090 -2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 2.7590 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 1.9990 0.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 1.2080 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 0.2420 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.6320 -5.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -1.9720 -5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -4.5130 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -2.9750 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -3.6360 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 -5.0520 -6.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -6.3270 -7.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -5.7020 -8.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -3.8130 -7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -0.5080 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 0.8320 -5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 2.1590 -7.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 3.0420 -7.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 2.5970 -5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 1.2630 -3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 1.1480 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 2.3880 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 3.3140 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 3.4560 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 0.6400 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 1.8590 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -0.3230 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -0.4450 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -2.1520 -6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -0.5870 -5.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -1.6900 -4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -0.9510 -4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 -1.9570 -6.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -2.4440 -5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END