IBS-ZINC04785928 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 2.0380 1.1360 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -0.3500 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -0.7180 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -2.0060 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.7940 0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -2.4400 2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -3.6950 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -3.6930 4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -4.6570 5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -4.3440 6.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -3.0760 6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -2.1180 5.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -2.4130 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -1.6740 3.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.7550 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -5.2780 7.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -4.8890 8.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -4.7550 2.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -6.0220 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -6.2440 3.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -7.1640 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -8.7310 2.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -9.9280 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -11.2790 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -12.2150 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -11.8090 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -10.4660 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -9.5250 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 1.3240 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 1.4170 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 1.7260 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.5390 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -0.9410 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -5.6410 4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -2.8410 7.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.1380 5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -4.0430 9.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -5.7240 9.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -4.6020 8.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -4.5820 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -7.1730 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -7.0390 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -11.5970 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -13.2650 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -12.5430 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -10.1520 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -8.4760 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END