IBS-ZINC02281912 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 0 0 0 0 0 0999 V2000 0.6220 -1.0340 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.4840 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -1.3110 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.5030 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -2.9440 0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -3.7560 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -2.0390 0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -1.0290 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -0.0660 -1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -2.1580 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 -1.3150 0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -1.5690 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6360 -0.8100 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8070 -1.2330 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8500 -2.4110 1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 -3.1670 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5110 -2.7540 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -3.4850 1.4630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -3.1780 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -4.5730 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -5.1970 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -4.4450 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -3.0630 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -2.4250 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 0.8730 -1.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 1.2700 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 2.6020 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 2.9910 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 2.0570 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 0.7310 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 0.3360 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 2.5580 3.9940 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 1.4000 4.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 3.7570 3.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 2.9720 4.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -0.4240 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -2.0900 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6180 0.1090 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7040 -0.6440 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7770 -2.7340 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7440 -4.0840 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -5.1620 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -6.2760 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -4.9390 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -2.4820 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -1.3470 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 1.5400 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 3.3320 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 4.0260 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 0.0040 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -0.7000 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 2.9080 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 3.2780 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 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 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 34 2 0 0 0 0 32 35 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 M END