IBS-ZINC05274291 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7260 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1240 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7150 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -1.9990 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6720 -1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.6570 -2.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.7030 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.4690 -4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -3.4070 -4.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -4.3610 -3.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -3.5950 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -4.0700 -6.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -5.0040 -6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -5.6570 -7.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -5.3520 -8.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.4150 -8.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.9550 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -2.1580 3.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6390 -1.9220 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -0.8570 3.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0280 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 1.1670 2.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.9770 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -3.3980 5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -4.1490 6.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -4.4800 7.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -4.0600 6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -3.3130 5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -2.9060 5.1680 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -1.1280 -3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -1.0270 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -1.7650 -5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -3.0220 -4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -5.0370 -3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -4.9360 -3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -4.2990 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -3.0420 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -5.2170 -5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -6.3870 -7.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -5.8450 -9.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -4.1750 -8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -3.2810 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -3.8310 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -1.0830 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.3120 4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -3.1390 4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -4.4780 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -5.0670 8.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -4.3180 7.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -3.8040 -6.9990 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 23 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 55 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 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 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 M END