IBS-ZINC05053930 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0110 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 -0.2780 -0.7040 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.0830 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -2.0620 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.6820 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 0.0870 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 0.5590 -2.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 1.2750 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 1.5280 -4.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 1.7600 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 2.5080 -4.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 3.8530 -4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 4.1190 -6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 2.9680 -6.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 2.0000 -5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2540 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -5.0100 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -4.3710 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -5.1240 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -6.5110 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -7.1640 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -6.4200 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -7.0620 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -8.2760 -0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -6.2860 -0.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -4.8930 -0.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -6.9230 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.8780 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 1.8680 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 1.8520 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -0.1690 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -2.6280 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.5910 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.5620 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.9410 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 0.3560 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 2.4090 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 0.9050 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 4.5640 -4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 5.0900 -6.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 0.9630 -5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -3.2920 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -4.6300 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -7.0850 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -8.2430 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -7.0850 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -6.2780 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -7.8810 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 28 2 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 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 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 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END