IBS-ZINC02231418 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 1.4180 1.3210 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -0.0240 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -0.7090 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -0.0650 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 1.3100 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 1.9840 1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 2.0670 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 1.4150 -1.4000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0150 -0.7120 -0.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -2.0970 -1.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9350 -2.7650 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -2.5170 -1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -2.3240 -1.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -3.1710 -3.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -3.2490 -3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -3.8150 -4.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -2.3970 -1.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -3.7590 -4.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -5.1340 -3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -6.2670 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -7.5310 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 -7.6930 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 -6.5530 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 -5.2890 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -9.0600 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -10.0260 -2.5050 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0150 1.8560 3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.5450 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -1.7570 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 3.0390 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -0.0520 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -3.8240 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -3.1010 -4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -6.1780 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -8.4020 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4140 -6.6500 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 -4.4220 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 3.2820 -0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3010 -9.1450 -1.7290 O 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 38 2 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 39 2 0 0 0 0 M CHG 1 8 -1 M CHG 1 26 -1 M END