IBS-ZINC04812095 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.2480 0.9040 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.4550 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.9920 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -0.1710 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 1.1880 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 1.7250 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.7560 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -1.1420 -1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -1.6970 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 -1.9420 -0.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3150 -2.4860 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -2.7420 -0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 -2.7620 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 -3.3290 -3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 -3.8350 -2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7200 -4.3760 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5500 -4.7520 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8960 -4.4610 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6950 -3.9140 -1.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 -4.7040 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7060 -5.2790 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2090 -5.5080 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4660 -5.1760 2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2060 -4.6090 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 -4.3660 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4260 -4.2610 3.6950 N 0 3 0 0 0 0 0 0 0 0 0 0 10.9280 -4.4900 4.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 -3.7230 3.5750 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8150 -2.2290 -3.2630 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 1.3230 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -1.0960 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -2.0540 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 1.8300 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 2.7870 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -0.0150 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -1.6350 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 -1.0020 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 -3.3730 -4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9100 -4.4590 -4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5300 -5.1930 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2850 -5.5380 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1880 -5.9490 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8710 -5.3610 3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7070 -3.9210 1.1480 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END