IBS-ZINC02130648 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1660 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -0.4440 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8430 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.6180 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -1.9980 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.7470 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -4.1670 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -2.4520 -4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -3.7390 -4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -4.2560 -5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -3.4890 -6.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -2.2350 -6.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -1.5580 -6.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -1.7030 -5.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.3300 -4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.3570 -4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -5.5520 -6.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 -6.0870 -7.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -7.5370 -7.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -8.0960 -8.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -9.4500 -9.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 1.2440 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -3.6960 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -4.6440 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -4.4820 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -4.4590 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -4.3480 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -0.3490 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 0.2170 -5.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 0.3890 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 1.3710 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -6.1100 -5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -5.4890 -8.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -6.0510 -7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -8.1350 -6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -7.5730 -7.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -7.4980 -9.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -8.0600 -8.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -9.8690 -9.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 M END