IBS-ZINC06645550 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.7060 2.7650 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.5050 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 0.4530 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 0.6510 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 1.9210 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 2.9740 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -0.4900 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -1.1940 -1.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5110 -0.4770 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -2.1030 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -3.3000 -0.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -1.9840 -2.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -1.5400 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -0.4470 -4.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -2.5330 -4.5640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1490 -2.8070 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -3.8000 -4.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -4.7600 -5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -4.0990 -7.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.8360 -6.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -1.8760 -5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -2.7300 -6.9670 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -1.3330 -6.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -3.5930 -8.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -3.4520 -5.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -2.6350 -4.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -3.1980 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -4.5640 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -5.3700 -4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -4.8150 -5.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.5820 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 1.3420 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.5270 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 2.0940 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 3.9540 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -0.0890 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -1.2150 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -2.9220 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -3.5380 -5.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -4.3080 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -5.6410 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -5.1170 -5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -3.8700 -7.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -4.7990 -7.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -1.0110 -5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -1.4830 -6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.5690 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -2.5740 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -4.9990 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -6.4310 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -5.4490 -6.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 -1.5470 0.0610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 38 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 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 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 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 1 52 -1 M END