IBS-ZINC02365836 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.1870 1.4560 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0560 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.4680 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -1.9940 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -2.4310 -0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6240 -1.9020 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -3.9190 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -4.3050 -0.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -4.7780 -0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -4.4830 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -6.2240 -0.5250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3120 -6.6050 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -6.5450 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -6.0280 -2.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -4.9270 -3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -4.4490 -4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -5.0670 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -6.1620 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -6.6420 -3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -6.9760 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -6.2360 0.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -2.0990 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 -1.2490 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 -0.6530 0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -1.0710 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 -0.2830 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -0.1560 4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -0.8130 5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -1.5940 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -1.7310 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -2.5190 3.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -2.6920 2.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 1.7280 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 1.9150 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 1.8800 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -0.4520 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.4870 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -0.0610 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.0330 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -2.3860 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -2.4170 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -6.1430 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -7.6300 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -4.4340 -3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -3.5940 -5.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7290 -4.6920 -5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -6.6410 -4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -7.4910 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 0.2260 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6410 0.4520 4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -0.7180 6.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -2.1060 5.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -8.2130 0.4030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 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 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 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 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 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 48 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 M CHG 1 53 -1 M END