IFLAB-ZINC04553834 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.2970 -2.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -0.2740 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -2.2400 -1.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -2.9400 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -4.4310 -1.6690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3620 -4.8400 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -5.1510 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -6.1370 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -6.6470 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -6.0760 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -4.8150 -2.8600 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -4.6500 -3.2480 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -4.1940 -4.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -4.2530 -3.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -6.3960 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -7.0520 -4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -8.4220 -4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -9.1360 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -8.4800 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -7.1090 -2.9820 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.7440 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.8090 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.5310 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -6.5090 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -7.4480 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -6.3440 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -6.4950 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -8.9350 -4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -10.2070 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -9.0380 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -6.5960 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END