ASINEX-ZINC00626512 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.1620 0.2820 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 2.7870 1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 3.1510 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 2.8230 -0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 3.1110 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 1.2510 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 1.8400 0.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6630 2.9300 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 1.4320 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 2.1900 -1.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 1.7640 -2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 0.5720 -2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 0.4290 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 1.4480 -4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 2.6340 -4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 2.7940 -2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 3.8460 -2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 3.4410 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 4.2540 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 5.5010 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 5.9210 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6650 5.1120 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5710 7.6140 -1.1110 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 1.2290 -6.8280 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 1.3280 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 1.7780 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 0.2420 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 0.4360 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -0.6350 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 2.7570 2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 3.5080 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 4.2200 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 2.5870 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 1.7210 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 0.1730 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 0.3680 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 1.6120 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -0.2300 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 -0.4920 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 3.4270 -4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 3.9370 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 6.1380 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 5.4430 -3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.4300 1.2150 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4440 1.4320 0.1800 H 0 0 0 0 0 0 0 0 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 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 44 1 0 0 0 0 3 4 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 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 43 1 0 0 0 0 25 26 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END