IBS-ZINC06664673 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.1630 2.0290 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 0.6640 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -0.0120 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 0.6660 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 2.0350 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 2.7130 -1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -0.1170 -1.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 0.4880 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -0.5960 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 -0.0720 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8720 -1.0880 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8440 -1.3010 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -0.6900 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 -1.1910 -2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 -2.2580 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6760 -2.8590 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5870 -2.3680 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0920 -2.7900 0.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0630 -2.0020 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 -2.1330 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9050 -3.8750 3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 -4.8920 4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7150 -4.2300 5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6570 -3.3620 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8940 -2.3450 4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 2.5590 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 0.1280 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -1.0770 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 2.6060 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 3.7790 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 1.2950 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 0.8790 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -1.4470 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 -0.9930 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 0.7880 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 0.2660 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5480 0.1360 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4830 -0.7420 -3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8240 -2.6280 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2620 -3.6900 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 -1.1780 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 -2.5830 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 -4.3850 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 -3.1800 4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -5.4460 5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 -5.6260 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 -3.6110 6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2880 -4.9960 6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3570 -2.8420 5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2590 -4.0020 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3480 -1.6330 4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 -1.8000 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8820 -3.0620 3.1440 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4260 -3.7010 2.5340 H 0 0 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END