IBS-ZINC03881985 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 84 0 0 1 0 0 0 0 0999 V2000 0.6660 0.5830 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.9370 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7160 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -1.5980 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -1.9830 3.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2120 -3.5090 3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -3.9130 3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -3.2320 2.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1670 -1.7560 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -0.8460 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -1.1120 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9640 -2.6010 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6050 -3.0400 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -3.3240 2.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6180 -4.7940 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -5.0140 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -4.3810 1.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.9380 -4.4070 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -2.8430 1.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1220 -2.2490 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -3.0730 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 -4.4480 -1.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.5530 -4.3200 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -5.2520 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -5.7840 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7360 -6.5160 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3400 -5.1210 -2.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9210 -5.9000 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3190 -2.0940 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -2.6400 3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -1.2840 2.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7780 -0.2110 2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -1.3800 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -3.9670 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -1.4690 4.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -0.3200 4.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -1.2640 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 0.9000 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.1350 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.9070 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -2.7770 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -1.3640 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -2.2290 4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -0.5700 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -3.8870 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -4.0230 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -5.0050 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -3.7030 4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 0.1920 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 -0.5040 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 -0.7210 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -5.4230 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -5.2090 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3250 -6.0900 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5590 -4.6200 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2140 -2.1650 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7800 -1.2210 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2880 -2.5720 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -3.1410 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 -6.5080 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -6.3260 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -4.9850 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7670 -6.2400 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7720 -7.1450 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3570 -7.1480 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0670 -1.0320 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4000 -2.1420 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1990 -2.5300 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -1.6270 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -2.5730 4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -3.2090 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.7790 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.4070 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -4.9970 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -3.4530 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -4.0510 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -0.9690 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -2.3370 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.7380 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -2.2470 5.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 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