NIH-ZINC02979282 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 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 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4560 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8360 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -4.1710 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -2.5010 -4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -2.7130 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -3.3600 -5.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -3.6460 -5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 -3.3690 -4.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -4.3120 -6.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 -4.5150 -6.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4570 -5.6510 -5.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -6.8030 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 -7.9250 -4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 -7.9030 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0450 -6.7510 -3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6430 -5.6280 -4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2030 -6.7280 -3.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9510 -5.5110 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6630 -9.0090 -3.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 -10.1570 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1650 -3.4000 -6.5450 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3470 -4.1600 -6.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5280 -2.7220 -7.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3650 -2.2920 -5.1220 C 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 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1420 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.6840 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -4.4830 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -4.4590 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.6540 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -3.4640 -4.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -1.8670 -5.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -1.7490 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -3.3460 -3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -3.5810 -6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1540 -5.2750 -6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 -3.6780 -7.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 -6.8210 -5.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -8.8200 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2480 -4.7330 -4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2350 -5.2730 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3420 -4.7040 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8490 -5.6290 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 -9.9060 -2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 -10.4750 -4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2460 -10.9660 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5710 -2.8820 -4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 -1.6110 -5.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -1.7190 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 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 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 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 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END