IBS-ZINC02223276 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 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 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 -0.8500 -2.3360 4.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -3.3140 4.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -2.3420 6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -3.4630 6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -3.4200 7.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -2.2720 8.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -1.1550 7.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -1.1730 6.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -0.0910 6.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.0960 5.5470 N 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 1.1840 -2.1250 3.3780 H 0 0 0 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 -2.4610 -4.3580 5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -4.2870 7.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -2.2560 9.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -0.2680 8.5830 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 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 24 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 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 31 32 1 0 0 0 0 M END