IBS-ZINC03851894 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.5670 1.0960 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.2690 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -0.7940 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.2400 -0.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9240 -0.0820 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 0.9220 -2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -1.2330 -2.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -2.0630 -1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -3.4200 -2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -4.2100 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -5.4480 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -5.8630 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -7.0990 -3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -7.4740 -4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -6.6180 -5.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -5.3910 -5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -4.9950 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -3.8080 -3.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -3.8480 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -4.3020 0.1910 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4330 0.7740 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 1.0060 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 1.5010 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.8280 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.9550 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.1650 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -1.8180 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.8100 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -2.1010 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -6.0920 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -7.7730 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -8.4290 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -6.8990 -6.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -4.7250 -5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 1.8000 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 0.7230 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 0.5920 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -1.5550 -0.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -3.1280 0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 39 2 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 29 38 1 0 0 0 0 M CHG 1 20 -1 M END