PUBCHEM-ZINC03951308 MOE2007 3D CORINA 3.40 0006 02.08.2006 83 87 0 0 1 0 0 0 0 0999 V2000 -0.5830 0.7190 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -0.6700 0.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -1.4180 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -2.7740 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -3.5320 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -2.9410 3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -1.5900 3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.8260 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -3.9110 4.9390 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -3.2280 6.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -5.2540 4.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -3.8630 4.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 -2.8140 5.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -3.3380 6.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 -2.2130 6.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -2.8620 7.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -4.3580 7.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -4.4030 5.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -4.8710 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -4.3260 2.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6330 -4.0110 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -5.4210 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 -4.9000 -0.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -4.3320 -0.8460 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6270 -3.4500 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -3.9470 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -4.3380 -2.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -4.8700 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -5.2830 -0.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -4.1780 -3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -5.4140 -4.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -6.4640 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -7.5980 -4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -7.6810 -5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -6.6300 -5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -5.4950 -5.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -5.3780 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 -4.7350 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4910 -4.0740 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6160 -3.4840 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8410 -3.5570 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9420 -4.2190 -3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8200 -4.8120 -2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 -3.2090 2.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 1.1870 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 1.1980 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 0.8300 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -3.2360 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -4.5880 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -1.1310 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.2300 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 -2.5290 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -1.9460 5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -3.7500 7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -1.4400 6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -1.7840 7.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 -2.4040 7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8610 -2.7470 8.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 -4.7300 6.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 -4.9370 7.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 -5.3880 5.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 -4.1290 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -5.1030 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -5.7750 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -5.7360 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -6.2730 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -2.8740 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 -4.5020 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -4.0320 -2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -3.3130 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -6.4000 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -8.4190 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 -8.5660 -6.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -6.6950 -6.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -4.6720 -5.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 -5.7800 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 -6.1850 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3150 -4.0170 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3180 -2.9670 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7190 -3.0960 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1180 -4.2750 -4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1200 -5.3330 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 -3.4170 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 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 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 50 1 0 0 0 0 8 51 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 59 1 0 0 0 0 17 60 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 19 20 1 0 0 0 0 19 63 1 0 0 0 0 19 64 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 44 1 0 0 0 0 22 23 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 37 1 0 0 0 0 26 27 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 30 31 1 0 0 0 0 30 69 1 0 0 0 0 30 70 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 71 1 0 0 0 0 33 34 1 0 0 0 0 33 72 1 0 0 0 0 34 35 2 0 0 0 0 34 73 1 0 0 0 0 35 36 1 0 0 0 0 35 74 1 0 0 0 0 36 75 1 0 0 0 0 37 38 1 0 0 0 0 37 76 1 0 0 0 0 37 77 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 78 1 0 0 0 0 40 41 1 0 0 0 0 40 79 1 0 0 0 0 41 42 2 0 0 0 0 41 80 1 0 0 0 0 42 43 1 0 0 0 0 42 81 1 0 0 0 0 43 82 1 0 0 0 0 44 83 1 0 0 0 0 M END