ANALYTICONDISCOVERY-ZINC08299905 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.7500 0.3770 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.1310 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -1.5170 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 0.8700 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 1.1510 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 2.0280 2.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 0.3410 1.4330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 0.4870 2.5580 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4260 1.5560 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -0.2540 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -0.4330 3.8100 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7630 0.3770 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7720 -1.7750 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -2.5300 3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 -2.0620 5.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1390 -1.3820 6.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1550 -1.6210 7.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1620 -0.9780 8.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1350 -0.0980 8.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 0.1080 8.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0870 -0.5320 6.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -0.3570 6.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -0.2200 6.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -0.3370 4.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -0.1210 3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1590 0.5890 10.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2210 1.2220 10.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 1.7780 12.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 1.5420 12.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 0.6530 11.2510 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.2220 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -1.1580 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -0.6400 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -0.3070 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 1.3620 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 0.4630 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -1.4860 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -1.9060 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.2440 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 1.8390 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 0.5140 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.3740 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 0.3040 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -1.2170 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8910 -2.8790 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9790 -2.2920 7.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9760 -1.1810 9.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 0.7730 8.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -1.0960 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 0.5310 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2100 1.2960 10.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 2.3230 12.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 1.8480 13.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -0.5350 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 0.7780 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -2.3210 -1.6410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 56 -1 M END