ASINEX-ZINC04981721 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.0420 1.4640 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -0.0260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -0.7260 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -2.0920 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -2.7630 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -2.0700 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -0.6960 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0100 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.7130 -3.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4090 -1.7340 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 0.0200 -4.6410 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0980 1.0770 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.1600 -6.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0530 -0.7090 -6.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.9800 -5.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7010 -2.0430 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -0.7140 -4.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.5150 -6.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7870 -0.7320 -7.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -1.2520 -6.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -0.9060 -7.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 0.8920 -6.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 1.1100 -6.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -0.5820 -4.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -4.2260 -0.0960 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9820 -4.8390 0.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -4.8180 -1.1600 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1100 1.6680 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 1.9120 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.8880 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -0.2050 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.6370 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -2.5950 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.9780 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -2.3280 -6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -0.9660 -5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -1.3380 -7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 1.1580 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 1.6880 -6.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -0.5500 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 22 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END