IFLAB-ZINC04086916 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 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 -1.4000 -1.9640 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -2.3930 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -1.8070 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -0.8120 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -0.3780 -2.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 -1.5480 -1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -2.2410 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -3.3120 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -3.0510 1.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7060 -4.5890 -0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -5.5990 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 -6.9740 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 -1.7700 -1.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -1.0320 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 -0.1740 -3.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1160 -1.2730 -3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4950 -0.3090 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2170 -0.5990 -4.9320 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.4680 0.5810 -6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7000 0.6650 -6.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8930 1.5910 -7.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8630 2.4350 -8.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6360 2.3540 -7.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4370 1.4350 -6.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -0.1660 -1.2340 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 -0.7100 -2.2160 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -2.4820 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -3.4800 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.0160 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 -5.5980 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 -5.3780 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -6.9750 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -7.1950 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -7.7330 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 -2.4560 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2270 -2.3000 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7700 -1.1060 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3840 0.7180 -4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8410 -0.4760 -5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5050 0.0060 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8500 1.6560 -8.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0160 3.1580 -9.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8330 3.0150 -7.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4800 1.3760 -6.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.5370 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 0.9160 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 54 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 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 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 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 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 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 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END