NCID-ZINC04962348 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 0.1410 1.5360 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.1720 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -0.5880 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 0.0390 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 1.4120 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 2.1510 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 2.1230 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 2.7690 -1.5770 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 3.7670 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 4.3540 -2.5870 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4690 3.5480 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 5.1650 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3840 6.3720 -1.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 4.3900 -2.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8350 4.9030 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8540 3.7680 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4070 2.6090 -1.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 5.2340 -3.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 5.4200 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 4.8860 -5.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 6.3560 -5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 6.6200 -6.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 7.5040 -7.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0870 8.4250 -6.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 7.8680 -8.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 7.4850 -9.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -0.7960 -0.3530 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6750 -0.9800 -1.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -1.2580 0.5770 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7270 2.1240 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.2970 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -1.6520 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 3.2200 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 2.9580 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 1.4620 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 4.5720 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 3.1300 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 3.3850 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2050 5.5900 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6810 5.4620 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 5.7390 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 5.9010 -4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 7.3020 -4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 7.0950 -6.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 5.6690 -7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9880 4.1320 -0.9550 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4030 8.4510 -9.0670 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8730 6.7730 -7.0960 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1740 7.2250 -6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 5.7620 -6.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 6.8970 -8.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M CHG 1 46 -1 M CHG 1 47 -1 M CHG 1 48 1 M END