IBS-ZINC06623774 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -1.7620 0.8220 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -0.3680 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -0.9030 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0160 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.6240 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -2.0550 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -0.9690 -1.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -2.6380 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -3.6050 -2.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.0050 -3.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -2.3250 -4.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0030 -3.3770 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.3980 -5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -1.5960 -5.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -2.6470 -5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -2.8380 -5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 -1.9820 -4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 -0.9350 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -0.7420 -4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -2.0720 -5.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -1.1960 -5.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -2.2820 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -3.2540 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -3.2280 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -2.2540 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.2800 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.3210 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -0.5040 2.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 0.2830 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 1.6990 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 1.0460 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 0.6320 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -3.4890 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -1.2550 -3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.5410 -6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -0.3460 -5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -3.3270 -6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -3.6580 -5.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -2.1350 -4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -0.2740 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 0.0690 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -4.0190 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -3.9770 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -2.2500 6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -0.5230 5.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -2.7600 -6.6820 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 46 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 46 -1 M END