IFLAB-ZINC02966265 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0740 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7650 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0480 -3.1490 -3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.9200 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -2.9370 -3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -4.2070 -4.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -4.1210 -5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -3.7950 -4.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.1120 -4.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2220 -3.1630 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -5.5540 -3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -6.2760 -4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -7.5820 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -7.9220 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -6.5410 -2.8780 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -3.8090 -5.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2710 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5170 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0190 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -3.7140 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -1.9540 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -2.9210 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -2.0620 -4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 -5.0760 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -4.3030 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -5.0790 -5.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -3.3410 -5.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -2.2940 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -3.6910 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -5.8710 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -8.2740 -3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -8.8950 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -4.0010 -5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 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 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 23 46 1 0 0 0 0 M CHG 1 9 1 M END