IFLAB-ZINC04166875 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4520 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8360 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.6040 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -4.3630 -2.2930 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -4.6970 -2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -4.8500 -1.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -4.8220 -3.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.4400 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -5.2780 -5.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -4.8850 -7.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -5.7800 -8.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -4.9320 -9.7430 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -3.4140 -9.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -3.6440 -7.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -2.0920 -9.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -1.9740 -10.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -0.7370 -11.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 0.3840 -10.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 0.2730 -9.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.9580 -8.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -2.4390 -4.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -1.5860 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.2390 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.1470 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.5900 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -5.3440 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -3.3830 -5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -4.6160 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -6.3340 -5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -5.1020 -5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -6.8400 -8.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -2.8480 -11.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -0.6440 -12.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.3490 -11.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 1.1520 -9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -1.0440 -7.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -0.9650 -5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 -0.9490 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -2.1940 -6.0570 H 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 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 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END