IBS-ZINC01894411 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 0.7480 1.6030 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 0.4030 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 0.6740 -0.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9350 1.6000 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -0.5330 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -1.3460 -0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 0.7820 0.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -0.1000 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 1.9220 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 3.0350 1.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 1.7110 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 2.4670 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 2.4580 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 2.9030 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 2.8950 6.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 2.4490 7.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 2.0150 5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 2.0180 4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5580 1.5500 5.9800 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.1020 1.6090 7.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1090 1.1290 4.9530 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9460 0.7590 3.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 0.0890 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.3460 2.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.9860 4.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -1.1720 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.1730 5.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.9960 6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.8240 5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.8220 5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 1.3810 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 2.4820 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 1.8540 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 0.1110 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.4420 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 3.1680 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 3.2630 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 3.2410 7.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 2.4530 7.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 1.6790 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 0.5610 4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -0.5410 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -2.3150 6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -3.7820 7.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -3.4800 6.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -1.7300 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -0.5480 -2.6060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 47 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 41 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 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 46 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 47 -1 M END