IBS-ZINC00107614 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.0860 1.3150 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -0.1660 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.8790 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -2.2420 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -2.9050 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.2210 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -0.8580 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -0.1080 -2.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -0.6940 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.0130 -4.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.1570 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -2.8720 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -4.3160 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -4.8290 -3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -5.1760 -4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -4.1420 -5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -2.6980 -4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.1610 2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.8130 3.6510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6620 -1.7530 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -1.0610 4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 0.1370 4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 1.2420 4.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 1.8660 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 1.6390 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.5950 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -2.8130 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -3.9730 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -4.4190 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -4.9820 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -4.0970 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -5.7340 -3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -5.3160 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -6.1420 -4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -4.3060 -6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -4.3120 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -2.1040 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -2.5590 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -0.1440 4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -1.4530 5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -1.7790 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -0.3230 4.2710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 18 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 42 -1 M END