IFLAB-ZINC04570680 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0660 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2510 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -5.0010 -1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.3010 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -6.7080 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -5.2810 1.4080 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -7.2740 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -6.9870 -2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -7.9320 -4.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -8.1100 -5.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -9.0590 -6.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -8.2740 -4.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -6.5780 -5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -6.3550 -7.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -5.1550 -7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 -4.1720 -7.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -4.3970 -5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -5.6040 -5.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -3.4360 -5.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 -3.7360 -4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -2.9910 -7.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -2.8300 -9.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5970 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -7.7340 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -7.1640 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -8.2910 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -7.0960 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -5.9690 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -8.4540 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -7.1190 -7.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -4.9830 -8.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -5.7830 -4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 -2.8870 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -4.6140 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -3.9360 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -2.9210 -8.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -3.6000 -9.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -1.8460 -9.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 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