IFLAB-ZINC02457633 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4900 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.6300 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0080 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -2.7540 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -4.1740 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -2.6620 4.5100 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -3.9510 4.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -1.7190 5.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -2.9060 5.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -4.1450 5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -4.7950 7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -3.7750 8.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.5360 8.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -1.8880 6.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -3.9730 9.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -5.0000 9.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.9190 10.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -3.3580 11.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -2.5170 12.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.8820 12.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -2.0270 13.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -0.8050 14.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.4410 13.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -1.2970 12.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 0.0360 15.1400 O 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 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1000 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -3.7080 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.6480 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -4.4700 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.4890 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -3.9150 5.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -4.8280 4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -5.6050 7.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -5.1860 7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -1.8530 8.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -2.7660 8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -1.0810 6.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -1.4940 6.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -2.7490 10.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -1.9910 9.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -3.8330 12.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -2.3110 14.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 0.5110 13.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -1.0160 11.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -0.0960 15.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END