IFLAB-ZINC04061807 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.1810 1.5260 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.0740 -0.5630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4820 -0.0290 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.3170 -0.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9650 0.3590 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -0.2250 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 0.7910 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 0.6540 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -0.4720 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -1.4370 -3.1700 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -2.1270 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -3.5830 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -3.7000 1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -3.2880 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -1.8280 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.8030 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -1.0110 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -0.2500 -0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -1.8180 -2.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -1.9540 -2.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -2.1540 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -2.2890 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8820 -2.2260 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 -2.0270 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -1.8960 -3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -1.7060 -4.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -1.6570 -5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 1.8370 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 1.6080 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 2.1660 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 1.6540 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 1.4030 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -0.7470 -5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -2.0440 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -1.4960 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -3.8900 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -4.2210 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -3.3820 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -3.9170 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.1930 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -1.5270 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -1.2340 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -2.3040 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -2.2030 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -2.4440 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 -2.3320 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -1.9770 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -0.8350 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -2.5970 -5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -1.5020 -6.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -1.6950 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 51 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END