PUBCHEM-ZINC03870442 MOE2007 3D CORINA 3.40 0006 02.08.2006 84 87 0 0 1 0 0 0 0 0999 V2000 2.2440 1.5790 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 1.3770 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 2.0320 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 1.8820 -3.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 2.7910 -1.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 3.2120 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 2.9980 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 2.4560 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 2.6820 -0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8130 1.7130 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 3.6810 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 3.5620 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 3.8100 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 3.1520 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 3.5940 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 3.5720 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 4.0150 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3110 3.9930 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 4.4350 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 4.4130 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8570 4.8560 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2450 4.8340 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3240 5.2770 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7120 5.2570 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7810 5.6980 -2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3170 5.9690 -3.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 -17.2100 5.3490 -4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2380 7.4610 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5850 8.0120 -3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.6280 7.8600 -2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.6430 6.4650 -2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.6210 5.5950 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.8020 4.2270 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.9130 3.8510 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.9980 4.8280 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.0160 4.5180 -0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -20.7890 6.0810 -1.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 -21.5490 6.7420 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 1.0420 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 0.7230 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 4.7130 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 3.5110 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 4.2840 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 2.5620 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 3.5610 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 4.8730 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 3.8250 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 2.1220 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 4.6070 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 2.9330 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 2.5600 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 4.2340 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 5.0270 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 3.3530 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5340 2.9800 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 4.6540 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 5.4470 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3790 3.7730 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 3.4000 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7890 5.0750 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6330 5.8680 -2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8460 4.1940 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4690 3.8220 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2550 5.4960 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1000 6.2890 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3140 4.6150 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9340 4.2450 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7220 5.9190 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6040 6.7220 -3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8350 5.0200 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8840 8.0640 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5090 7.5950 -4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4860 9.0690 -4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.9150 7.4800 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4210 8.5690 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.6110 8.1160 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0410 3.4810 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.0780 2.8410 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 3.1960 -0.8900 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1530 4.1560 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 2.6500 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1140 5.6640 -2.2700 N 0 3 0 0 0 0 0 0 0 0 0 0 -16.2330 4.7320 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1150 6.3100 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 8 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 13 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 9 79 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 79 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 22 23 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 24 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 25 82 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 26 82 1 0 0 0 0 28 29 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 30 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 31 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 32 2 0 0 0 0 31 37 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 77 1 0 0 0 0 34 35 1 0 0 0 0 34 78 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 79 80 1 0 0 0 0 79 81 1 0 0 0 0 82 83 1 0 0 0 0 82 84 1 0 0 0 0 M CHG 1 79 1 M CHG 1 82 1 M END