IBS-ZINC02126910 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 54 0 0 0 0 0 0 0 0999 V2000 0.0470 1.2640 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.1010 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -0.7440 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -0.0250 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 1.3560 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 1.9930 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 1.8190 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 3.0530 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8270 3.1250 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 2.0380 -0.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 0.8480 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 0.6880 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -0.4010 -0.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 -1.3060 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 -0.3260 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -1.5780 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 -2.6710 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3990 -2.5290 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7180 -1.2790 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 -0.1820 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8350 -1.4060 -2.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9600 -2.8150 -3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3180 -3.4360 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 4.4280 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 5.4550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 4.4760 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5630 5.7620 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5310 5.6800 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3500 4.5160 1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6240 3.2840 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 3.2430 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 1.7570 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.6640 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -1.8070 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 3.0550 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 3.9400 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -1.6930 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -3.6400 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 0.7850 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4440 -3.0760 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0090 -3.1040 -3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 5.9550 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 6.5620 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1620 6.5690 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9640 5.6170 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3220 2.4500 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0580 3.2130 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0050 2.3770 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2280 3.1780 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 M END