CHEMDIV-ZINC06805655 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.3380 1.3590 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -0.1590 -0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0940 -0.6320 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.4930 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -1.9870 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.5450 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -2.2400 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -0.3980 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -0.8460 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -0.2180 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 1.0950 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 1.8460 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 1.5780 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8100 0.7800 -2.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8640 1.2610 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2300 2.6170 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 3.1160 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9320 2.2720 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5790 0.9260 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 0.4100 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0930 -1.2980 -0.1290 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.4820 -2.0190 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2220 -1.1110 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -0.4330 -2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 -0.9520 -3.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 1.7870 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 1.6390 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 1.8370 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -0.1280 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 0.0290 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -2.5020 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -2.1740 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -3.6290 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -2.1210 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -2.7120 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -2.5910 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -0.8620 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 0.6860 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -1.9250 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -0.6010 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -0.7560 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7530 2.6410 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 1.4750 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 3.3050 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5370 4.1660 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7290 2.6620 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1040 0.2860 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -2.9290 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5330 -2.3280 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2400 -1.7020 -3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0170 -0.3660 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -0.7420 0.1100 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0340 -0.2960 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END