IBS-ZINC06719898 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 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 0.5150 -0.3410 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.4760 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -0.6910 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.6790 2.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -0.6350 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -1.2220 3.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 0.0290 2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 0.6170 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 1.2500 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 1.3140 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 0.7400 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 0.0970 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -0.4730 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -1.0050 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.2660 4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 1.3380 3.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 0.2060 5.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -1.0420 5.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -1.1220 6.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 0.0500 7.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -0.0090 8.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 1.1410 8.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 2.3820 8.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 2.4800 7.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 1.3130 6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 1.3790 5.7940 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 -3.0770 0.5720 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 1.6980 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 1.8150 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 0.7930 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -1.6440 4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -1.5270 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -1.9460 5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -2.0850 6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -0.9630 8.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 1.0910 9.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 3.2790 8.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 3.4480 7.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 2.3350 5.4590 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 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 2 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 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 M END