IBS-ZINC00497219 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.3360 1.4560 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -0.0180 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.8120 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -2.1540 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -3.4020 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -4.5630 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -4.4950 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -3.2820 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -2.1290 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.8350 -1.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.4030 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -5.6930 1.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -6.9120 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -0.2940 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 0.7870 2.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -1.0880 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 0.6620 4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 1.7390 5.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 1.0270 7.4040 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -0.0430 7.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -0.9740 6.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 1.8600 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 1.6760 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 1.9970 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -3.5020 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -5.3720 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -3.2510 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 0.0450 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -1.2530 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 0.3230 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -7.7100 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -7.1600 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -6.8710 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -1.8960 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -1.4700 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 1.1330 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -0.0100 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 2.3570 5.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 2.3990 5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -0.6360 8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.5900 7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -1.6390 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -1.5810 6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -0.1920 4.7950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2940 0.4610 4.7720 H 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END