IFLAB-ZINC03865508 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.2680 2.2560 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 0.7880 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 0.0160 1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.3340 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.8740 0.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -2.0270 2.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -3.4870 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -4.0390 3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -1.9090 4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -1.3900 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -4.0120 6.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -5.3030 6.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2670 -6.1100 5.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -5.7370 7.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -6.9660 8.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -7.6070 9.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -7.1330 10.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -7.8880 11.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -9.1220 11.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -9.6130 10.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -8.8440 9.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -9.3560 7.9620 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0310 -10.1780 7.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -8.9300 7.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0030 -5.0380 6.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -5.8070 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 2.5000 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 2.8890 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 2.4960 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 0.5540 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 0.5570 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -3.8860 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -3.8050 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -3.7830 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -5.1240 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -1.5440 5.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -1.6170 5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -1.6330 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.3010 3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.1580 6.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -3.2800 7.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -4.9870 8.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -5.8860 8.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -6.1810 10.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -7.5080 12.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -9.6960 12.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -10.5720 10.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -3.4250 4.9810 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3200 -3.7260 4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 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 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 48 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 9 48 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 48 1 M END