IBS-ZINC00123658 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -4.0180 0.6330 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -0.6870 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -1.2630 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -2.4740 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -3.0740 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -2.4280 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -1.2770 -1.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -4.3670 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -4.8740 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -4.9840 -1.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -6.1590 -1.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -6.7300 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -5.9910 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -4.5200 -3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -4.2400 -5.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -5.4460 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -6.4840 -5.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -7.8350 -5.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -8.2570 -6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -9.5900 -6.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -10.5050 -6.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -10.0880 -5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -8.7550 -4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -11.9330 -6.4450 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5760 -12.3320 -7.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -12.8050 -5.9520 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.2930 1.4470 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 0.6880 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 0.7180 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -0.7710 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -2.9460 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -2.8770 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -4.5460 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -7.7680 -2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -3.8100 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -3.2540 -5.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -5.5310 -6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -7.5440 -6.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -9.9190 -7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -10.8050 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -8.4300 -4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END