PUBCHEM-ZINC04654501 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.1060 1.4980 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -0.0280 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.5320 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.8800 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -2.4360 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -3.8050 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -4.6250 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -4.0680 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -2.6980 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -6.0120 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -6.5870 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -7.0030 0.4620 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -8.2300 -0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -6.2280 0.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -7.3600 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -8.4640 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -8.7600 3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -7.9480 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -6.8310 4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -6.5460 3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -5.9800 5.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9990 5.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -6.3640 6.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -7.4840 7.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -8.2330 6.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -9.0100 6.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -5.5670 8.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -5.9490 9.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -4.4130 7.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -3.5660 8.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -2.3450 8.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.1940 8.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -0.0950 7.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -0.1830 7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -1.2940 7.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -2.3560 8.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.8820 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 1.9140 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 1.7830 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.3130 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.4450 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -1.7980 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -4.2380 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -4.7040 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.2640 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -6.7880 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -7.5180 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -5.8840 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -9.0980 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -9.6220 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -5.6900 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -7.7660 8.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.1430 6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -3.2590 9.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -4.1260 9.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -1.1550 8.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 0.8170 7.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 0.6680 7.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -3.2470 8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 2 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 36 59 1 0 0 0 0 M END