NCID-ZINC05957541 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 0.5910 1.5540 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 0.1150 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9750 0.0960 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -0.5740 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -1.4560 -0.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.1040 -2.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -0.5270 -3.6570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4740 -1.5470 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 0.4400 -4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 0.6430 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 -0.3980 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -0.2020 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 1.0370 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 2.0810 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 1.8860 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.5140 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 0.1230 -4.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -1.2100 -5.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -1.2750 -7.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.0650 -8.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -2.5650 -7.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -0.6550 1.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -0.5250 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 0.2410 2.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -1.3800 3.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -1.4600 4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -1.9310 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.5260 5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.1300 5.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 1.5890 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 2.1340 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 2.0600 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 0.5600 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 0.0860 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 1.4150 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -1.3720 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 -1.0160 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1780 1.1870 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 3.0470 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 2.7100 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -1.7400 -5.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -1.7510 -6.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -0.2500 -7.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -1.3390 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -2.8360 4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -2.1450 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 -1.1790 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -2.2410 5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.6800 6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -3.4850 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 0.6540 4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.2310 6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 0.2330 5.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -2.1140 -9.2660 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 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 33 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 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 54 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 54 -1 M END