IBS-ZINC02136214 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 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 3 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -1.1720 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6340 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -0.3610 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -1.1330 3.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5950 -0.4500 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -2.5260 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -2.9740 4.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -3.6740 5.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -4.0850 6.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -3.7970 6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -3.0980 5.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -2.6900 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -1.2010 4.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -0.4690 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 0.2420 5.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.5560 6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 0.1670 8.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 0.0520 9.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -0.7770 8.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -1.4990 7.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -1.3960 6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -2.1040 5.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -2.6870 5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.9850 4.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -2.6180 3.5970 O 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 1.6540 -0.7070 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -3.2280 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -2.4930 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -3.8990 5.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -4.6310 7.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -4.1170 7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -2.8720 5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -2.1480 3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 0.8130 8.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 0.6100 10.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -0.8580 9.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -2.1420 7.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -0.1660 -2.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.5000 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 46 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 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 29 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 46 47 1 0 0 0 0 M END