IFLAB-ZINC04273084 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.0260 1.3750 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 0.0240 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -0.4680 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 0.3690 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 1.7290 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 2.2290 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 -0.1170 0.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 0.6920 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 -0.1420 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 -2.2380 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 -1.4170 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 -2.1910 0.5340 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4050 -1.4190 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1810 -2.9040 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1450 -1.9210 2.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 -2.3870 4.3970 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 -1.2630 5.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.8630 4.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 -3.7210 5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1040 -3.7340 6.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 -5.0440 6.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 -5.9890 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 -5.2930 4.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 -3.1000 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -2.9760 -1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 -4.1900 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9120 -4.9770 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -4.3230 -0.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.7590 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -0.6490 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -1.5250 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 2.4240 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 3.2840 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 1.5440 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 1.0920 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -0.4320 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 0.4250 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -3.1540 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -2.4860 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -1.2310 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -2.0120 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 -3.7720 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2090 -3.2580 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0420 -1.4520 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3880 -2.8390 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2620 -5.2830 7.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2230 -7.0560 5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 -2.1180 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5170 -4.4610 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 -5.9720 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -1.4160 0.9360 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6230 -1.1480 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 51 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 12 51 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 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 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END