NCID-ZINC04896982 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 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 1.7040 -1.1740 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1640 -2.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.6370 -3.6610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3250 -1.6320 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.6920 -4.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4230 -1.0900 -5.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 0.7220 -5.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1180 1.1040 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.5750 -5.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 1.7020 -4.3410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9540 2.0980 -3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 0.3270 -4.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7350 0.4130 -3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -0.1680 -5.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 2.5940 -4.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 3.9590 -4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 0.6840 -6.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 1.9800 -6.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -1.5340 -4.4780 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 -1.1310 -0.3610 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -1.0800 3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -1.2100 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -1.7180 5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -0.8250 6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -1.2910 7.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -2.6510 7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -3.5440 7.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -3.0780 5.9890 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 -0.5660 0.3830 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 0.3940 -5.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 4.5700 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 4.0440 -5.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 4.3030 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 0.3870 -7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -0.0350 -6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 2.0310 -7.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -1.6150 -5.1720 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 -0.4770 -0.2380 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -1.9130 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 0.2370 6.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -0.5930 8.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -3.0150 8.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -4.6070 7.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -3.7760 5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 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 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M END