IBS-ZINC00537135 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6740 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.0400 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -4.5860 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -3.7310 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -2.3480 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -4.5950 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -5.9150 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -5.8920 1.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -6.6780 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.9480 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -6.6310 5.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -5.3720 5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -4.3690 4.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -8.2750 3.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -9.1770 4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -10.6260 4.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0870 -11.3010 4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -10.8900 3.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -10.0300 2.9800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1620 -10.1660 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -8.5750 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -10.3730 2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -10.8410 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.2570 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -4.6900 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.6890 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -5.1580 6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -8.9540 4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -9.0380 5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -8.4270 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -7.9130 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -10.2360 3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -9.7170 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -11.4100 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -10.6360 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -11.8730 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -10.1670 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END