IBS-ZINC00703000 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 -0.0330 1.1660 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.3290 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.0980 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.3110 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 1.1590 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 1.5800 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 1.3980 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 0.7110 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 0.0650 0.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 0.6780 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 1.8280 -0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -0.5320 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 -1.8100 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -2.8090 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 -4.0120 0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3360 -2.1840 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1170 -0.7370 0.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6140 -0.3280 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 -0.0720 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2730 1.1020 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6650 1.5140 2.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3520 0.6740 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5090 -0.7230 3.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6390 -2.8430 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1950 -3.1270 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5560 -3.8150 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2750 -4.9540 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7620 -5.2600 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0290 -4.0320 -4.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8960 -3.1640 -4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 -2.8360 -2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -2.0610 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 1.4870 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 0.0090 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -0.7480 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 2.2310 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 2.0080 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 1.6870 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1850 2.4440 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 0.8290 4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3280 -2.1940 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5240 -3.7820 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 -3.7770 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3100 -2.1880 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2440 -3.1650 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4410 -4.7530 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0160 -5.8840 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0650 -4.4470 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6740 -5.8550 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9930 -5.8150 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1810 -2.2430 -4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1010 -3.6580 -4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1760 -2.2950 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5030 -2.2210 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 1.7050 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0900 -4.0870 -2.2720 N 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 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 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 56 1 0 0 0 0 M END