IFLAB-ZINC04554443 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -2.9810 1.0810 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -0.1970 1.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -1.2060 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -2.5240 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -2.9930 1.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -4.1430 1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -4.7900 0.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -4.6220 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -3.9740 4.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -5.7720 3.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -6.2410 4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -7.6030 4.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0820 -7.4960 3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -8.1280 5.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -8.3550 6.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -8.8360 7.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -9.0930 7.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 -8.8650 6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -8.3870 5.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 -9.1910 7.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -10.0060 8.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -9.5630 9.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -8.2000 4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -9.1670 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -10.5090 3.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -10.8770 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -9.9280 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 1.7900 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 1.4320 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 0.9940 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 -1.3400 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -0.9020 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -3.2700 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -2.3680 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -2.4760 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -6.2890 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -5.5250 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -6.3350 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -8.1540 6.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -9.0130 8.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -8.2130 4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -11.0610 8.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -9.8280 9.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -7.1800 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -8.2810 5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -8.9520 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -9.0470 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -11.9000 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -10.8070 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -10.0370 5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -10.1700 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -8.5430 3.6920 N 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 31 1 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 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 52 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END