IFLAB-ZINC04377338 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.4520 1.2360 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -0.2830 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.5960 -0.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -1.9120 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.2870 -1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -3.6260 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -4.5920 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -4.2200 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.8830 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -6.0520 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -6.5480 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -5.7910 -0.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -7.8280 -1.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -8.1840 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -9.0470 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -9.4010 0.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 -8.9250 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -8.0600 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -7.6580 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -6.8800 -2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6520 -9.3630 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 -8.5280 2.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4470 -9.2040 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 -8.8320 4.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 -9.3220 4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8130 -10.2330 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2140 -10.6000 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0420 -10.0770 2.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 1.6520 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 1.6640 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 1.4750 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.7100 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.6990 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -1.5330 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -3.9190 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -4.9770 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -2.5930 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -6.6210 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -6.1800 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -9.4560 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 -7.6820 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 -10.4420 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 -9.1040 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6010 -9.0140 5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7670 -10.6480 3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6960 -11.3080 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 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 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 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 M END