IBS-ZINC04090448 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 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 3 0 0 0 0 0 0 0 0 0 -1.0210 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.5030 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.3650 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.7920 3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -1.3640 3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -1.5040 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -1.0780 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -1.2890 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -0.3750 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.4760 -1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.9830 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -1.0560 -2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -1.4600 -3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -1.9840 -4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -2.4600 -5.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -1.7530 -6.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -2.5140 -7.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -2.2190 -8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -3.7620 -7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.7810 -5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -4.9310 -5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -6.0320 -5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -6.0180 -6.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -4.8960 -7.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -1.7850 4.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.3620 4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.6540 4.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -0.0570 4.8040 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 -0.8850 0.0810 2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -1.9470 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -1.0720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -2.3270 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 0.6550 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -0.6940 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -0.6310 -3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -2.2590 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.8120 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -1.1840 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -0.7340 -7.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -4.9490 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -6.9220 -5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -6.8960 -7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -4.8940 -8.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -1.6320 4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -2.6540 5.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -3.2410 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -0.6590 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -0.0070 5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 0.9490 4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 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 29 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 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 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END