OTAVA-ZINC05010559 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 -0.6880 1.6900 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 0.2080 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.3700 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.7480 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.5790 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -2.0010 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -0.6120 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -2.8160 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -3.9800 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -4.7240 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -4.2850 1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -6.1650 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -6.8860 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -8.2140 0.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -8.3720 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -7.1400 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -7.1230 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -8.3830 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -9.5940 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -9.6070 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -8.4010 1.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -5.8670 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -3.8170 2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -2.9970 4.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0960 -2.6490 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -3.7760 5.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -4.9820 5.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6950 -5.5390 6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -5.8610 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -4.6880 5.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -1.7760 4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -6.5330 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 2.1780 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 1.9280 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 2.1070 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 0.2470 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -2.1370 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.1610 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -3.5450 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -2.1880 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -3.3350 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.4910 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -10.5430 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -10.5310 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -9.3200 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -6.0650 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -5.2010 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -3.2520 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 -4.1520 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 -6.2210 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -6.7110 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -4.1410 4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -5.6150 5.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -4.0640 6.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -1.1270 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -1.1960 5.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -2.0720 4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -6.2350 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -7.3830 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -5.7080 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -5.0660 2.7640 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7550 -4.7350 2.5930 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 61 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END