PUBCHEM-ZINC03742462 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.6240 -0.4750 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -1.7050 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -1.3330 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -1.1680 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -0.8060 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 -0.5910 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -0.7390 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -1.1000 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -1.1560 -2.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -1.3760 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -0.8690 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -0.5980 -2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 -0.2680 -3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 1.2070 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 1.4640 -1.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -0.8550 -4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -1.9530 -5.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -1.9230 -6.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -0.8080 -7.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 0.3140 -6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 0.2760 -5.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 1.4090 -7.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 2.4150 -7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 3.4020 -8.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -0.9170 -8.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -0.4830 -9.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -0.7730 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 0.1310 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 0.1590 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.3370 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -2.3140 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -1.3220 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -0.6810 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -0.2930 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -0.5120 -4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 -0.8910 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -2.8430 -4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -2.7820 -7.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 1.1330 -4.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 1.9720 -6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 2.9440 -6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 4.2000 -7.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 3.8500 -8.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 2.8960 -9.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -1.0690 -10.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -0.6530 -9.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 0.5680 -9.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 1.9930 -3.8790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 48 -1 M END