PUBCHEM-ZINC04134476 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 77 0 0 1 0 0 0 0 0999 V2000 1.7240 0.3360 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -1.1590 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -1.5400 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -3.0950 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -3.6580 -4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -0.9310 -4.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -1.3710 -5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -0.9820 -2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -0.1470 -3.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -1.5310 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 -1.0920 -0.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6450 -0.9710 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 0.2530 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8640 0.8190 0.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5780 1.5710 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 -0.2430 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 -1.5600 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -2.1550 0.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7500 -2.9450 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -2.8540 1.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0830 -2.1200 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -4.0360 1.8480 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5480 -4.2810 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 -3.6440 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 -2.5040 1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 -5.3150 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -3.2800 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -3.8890 1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -4.2680 1.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2060 -3.4160 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -4.7120 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -5.1120 1.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1570 -4.2610 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -5.6040 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -6.0410 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -6.6120 1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -6.1550 0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -6.5270 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -5.3310 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -5.8170 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 1.5240 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 0.8600 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 0.7960 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 0.4990 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -1.5760 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -1.6280 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -3.4920 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -3.5110 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -4.7500 -4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -3.4220 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 -3.2800 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 0.1640 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -1.1660 -5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -2.4500 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -1.0960 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -0.8800 -6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 0.9720 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 0.1170 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 0.1170 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 -4.3240 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0730 -2.2470 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -5.1430 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -6.0940 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -5.7300 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -2.3930 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -3.9690 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -4.7880 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -3.1660 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -5.5820 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -3.9110 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -6.4800 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -4.8170 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1510 2.3150 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5990 1.9910 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 0.8320 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -5.7940 2.8520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 49 1 0 0 0 0 5 50 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 52 1 0 0 0 0 6 53 1 0 0 0 0 7 54 1 0 0 0 0 7 55 1 0 0 0 0 7 56 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 57 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 16 17 2 0 0 0 0 16 59 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 24 25 2 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 28 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 39 1 0 0 0 0 31 32 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 37 1 0 0 0 0 34 35 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 35 36 2 0 0 0 0 35 76 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 41 75 1 0 0 0 0 M CHG 1 76 -1 M END