IBS-ZINC02266520 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -4.6680 -8.1290 4.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -7.0870 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -7.2420 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -6.2890 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -5.1820 1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -5.0170 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 -5.9750 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -3.9930 0.9230 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -3.0470 0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -3.5330 1.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -4.8960 -0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -4.9290 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -4.1550 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -4.0940 -3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -4.8080 -3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -5.6380 -2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -5.7070 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -4.6540 -4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -3.5310 -5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -3.6620 -6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 -3.7420 -6.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -3.7580 -7.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 -3.9480 -8.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 -4.1730 -10.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -4.1440 -9.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -2.3800 -4.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -1.1830 -4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -0.9220 -5.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -0.1140 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 1.2200 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 2.2600 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 1.9730 -1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 0.6500 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -0.3960 -2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -7.6820 4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -8.8930 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -8.6110 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -8.1060 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -6.4180 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -4.1600 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -5.8500 3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -3.5740 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -3.4640 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -6.2060 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -6.3390 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -5.5540 -5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -3.7040 -7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 -4.8090 -8.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 -3.0550 -8.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -2.4330 -3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 1.4550 -5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3880 3.2920 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 2.7810 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 0.4290 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9250 -1.4130 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -4.3610 -11.1360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 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 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 M CHG 1 56 -1 M END