IBS-ZINC03984806 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 0.0860 1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -0.2590 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -1.0370 3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 0.3090 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -0.0460 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 0.4870 3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 1.3730 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 1.7300 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 1.1990 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -0.7840 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -1.2690 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -1.6950 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -2.0990 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 -2.5420 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9080 -2.9240 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7580 -2.8810 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5980 -2.4580 1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -2.0540 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 -1.6350 1.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -1.2510 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -0.8030 1.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 -1.7210 -2.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -2.9270 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.2350 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -0.7370 4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 0.2130 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 1.7880 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 2.4220 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 1.4740 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.6610 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0210 -2.5780 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8410 -3.2640 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5780 -3.1900 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -2.4310 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 -2.8130 -4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -3.1360 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -3.7520 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -1.4280 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END