PUBCHEM-ZINC03871755 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 2.1740 1.1630 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -0.1970 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -0.8850 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -0.2210 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 -0.9030 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 -0.2150 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 1.1430 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 1.8280 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 1.1620 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 1.8390 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 -1.1110 0.2880 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5540 -0.2130 0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2550 -2.3740 0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -1.4190 -1.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 -0.2690 -2.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8160 0.6720 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 -0.2380 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1850 -1.5620 -2.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6920 -2.1110 -2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4140 -0.5350 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 -1.6220 -3.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3580 0.4720 -4.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 1.8480 -4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 2.6260 -5.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 1.6530 -6.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 0.2780 -5.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6820 0.0430 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -0.8300 -6.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -0.9440 -8.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -1.8560 -8.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3040 -2.6080 -8.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 -1.8400 -10.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 -2.9060 -11.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 -2.9890 -12.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -5.3710 -13.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -5.8750 -12.1280 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0240 -6.8740 -11.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -5.2720 -11.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3670 -6.2280 -14.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 -5.9040 -14.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2880 -7.2300 -13.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 1.6980 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -0.7230 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -1.9480 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 -1.9680 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8780 1.6780 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 2.8880 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 2.9010 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2620 -2.1310 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9870 0.3680 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1840 0.1610 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 2.2100 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8760 1.8870 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 2.8230 -4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 3.5800 -5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 1.8770 -7.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7910 1.7110 -7.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 -0.6550 -6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2760 -1.8070 -6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 -0.3530 -8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -2.0120 -10.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -0.8450 -10.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2700 -2.6870 -11.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -3.8780 -10.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -3.1810 -12.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -2.0420 -13.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9360 -4.0360 -13.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 -3.7440 -14.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 42 1 0 0 0 0 2 3 2 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 44 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 45 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 10 48 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 35 36 2 0 0 0 0 35 39 1 0 0 0 0 35 67 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 36 1 M END