NCID-ZINC05706601 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4010 -2.1610 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -4.0940 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -4.7850 0.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -4.6690 -1.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -6.1280 -1.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1290 -6.5780 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -6.5460 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -6.1820 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -6.6780 -2.6700 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -6.1740 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -6.5950 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -5.7920 -2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -2.2210 1.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -1.0120 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -0.2310 0.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -0.6710 2.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 0.6470 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 0.8510 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 1.4000 5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 1.5870 6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0180 1.2250 6.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 0.6760 5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 0.4940 4.2140 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -4.1160 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -7.6220 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -6.0270 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -5.1060 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -6.7020 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -6.6930 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -6.4270 -2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -5.0970 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -2.8450 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 1.4070 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 0.7290 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 1.6830 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1160 2.0150 7.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4570 1.3700 7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7980 0.3930 5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7990 0.0680 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -7.9040 -2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -8.1560 -2.5170 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 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 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 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 18 19 1 0 0 0 0 18 46 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 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END