ASINEX-ZINC04908979 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0440 1.4030 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.0260 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -0.6560 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 0.0870 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -0.5500 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -1.9280 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -2.6840 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -2.0400 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -4.1600 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -4.8160 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -4.7800 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -6.2430 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -6.6910 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -8.2180 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -8.2900 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -6.7660 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3850 -10.1170 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -10.5030 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3930 -9.6550 3.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -11.7910 2.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -12.1640 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 -11.3020 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -11.6740 6.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -12.9020 6.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -13.7620 5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -13.3990 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -14.3230 3.4490 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2930 -15.4440 3.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -13.9630 2.2900 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9790 1.7780 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.7640 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.7570 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 1.1660 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 0.0340 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -2.4220 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.6190 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 -4.2560 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -6.6430 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -6.2580 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -6.3580 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 -8.5390 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -8.6500 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -8.7220 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -8.6650 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -6.4860 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -6.3340 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -10.6460 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -10.3830 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8380 -12.4580 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -10.3430 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6210 -11.0040 7.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -13.1900 7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -14.7210 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -8.6680 0.8360 N 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 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 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 54 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END