IBS-ZINC02131678 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 1.2980 0.6610 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.7970 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -1.6780 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -0.9220 1.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1110 -0.6010 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -0.0540 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -0.5510 -1.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -2.3180 0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -2.7810 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -2.0610 1.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -4.1920 0.5530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7250 -4.8830 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -4.3240 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -3.9340 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -5.7720 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -4.5100 0.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -3.8490 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 -4.0730 0.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 -5.0000 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7270 -5.2420 2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0080 -6.1920 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -6.9160 3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 -6.6950 3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 -5.7380 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -5.4630 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -6.0670 2.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.7500 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 1.2880 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 0.9820 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -1.1190 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -1.5890 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.3570 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -2.7170 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.9100 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -3.6650 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.6290 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -3.9710 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -2.9230 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -6.4390 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -6.0200 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -5.8870 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 -3.0990 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5280 -4.6850 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0340 -6.3780 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2300 -7.6570 4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -7.2600 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 1.2700 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 1.7860 -0.8140 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 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 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 25 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 47 48 1 0 0 0 0 M END