IFLAB-ZINC04194963 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.5120 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.0410 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -2.5950 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -1.9990 0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.5350 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -2.9580 -0.9500 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -2.1870 -2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -4.2230 -0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -3.2140 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -2.3360 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -2.5280 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 -3.6010 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -4.4910 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -4.2910 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 -5.6390 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -5.8120 2.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -6.4940 2.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -7.6330 3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -8.4280 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -9.5860 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -10.3150 2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -9.8870 3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -8.7300 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -7.9940 4.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -6.8520 4.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -6.4660 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -3.7880 1.1260 F 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 1.7560 -0.1150 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.1800 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -2.3740 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -2.4010 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -3.6780 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -2.3390 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -0.2590 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -1.4970 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9050 -1.8390 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -4.9760 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -6.3560 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -7.2700 4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -8.2690 2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 -9.9220 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -11.2200 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -10.4580 3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -8.3960 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -7.2510 6.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -6.3110 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -5.5400 6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END