IBS-ZINC05180128 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0460 1.1790 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 0.1540 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 0.7310 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.1500 -0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -1.4140 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -1.8080 -2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -3.0890 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -3.9970 -1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -3.5960 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -2.3140 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -5.3670 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -5.8490 -2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -6.1610 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -5.8280 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -6.9860 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -7.0250 -3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -7.9840 -3.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -7.5660 -3.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2130 -7.5740 -4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -8.4860 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -8.9890 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -9.8130 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -9.9780 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -9.0650 -0.7150 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -9.2800 -4.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -9.1650 -5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -8.2850 -5.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -8.0180 -7.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -4.7720 -2.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 1.4110 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 0.7680 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 2.0890 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -0.7560 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 0.0010 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 0.9630 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 1.6410 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -1.1070 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -3.3940 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -4.2920 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -2.0050 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -8.7710 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -10.2860 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -10.5830 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -9.5820 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -10.0260 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -10.1500 -5.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -8.7690 -5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -7.4160 -7.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -8.9600 -7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -7.4770 -7.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -6.7580 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 29 2 0 0 0 0 15 16 2 0 0 0 0 15 17 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 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END