CHEMDIV-ZINC00727897 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2700 1.0510 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 1.7170 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 3.3850 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 3.6270 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 5.1140 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 5.3450 -1.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 5.4660 -0.9590 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4550 4.4290 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 5.8870 -2.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9800 5.5240 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 5.3580 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 5.2220 -3.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 5.3740 -4.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 7.3600 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 8.1750 -2.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6500 7.8450 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 9.1800 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2260 9.6940 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1510 8.8750 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8460 7.5520 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 7.0340 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3540 9.3650 -0.9300 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 6.2870 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 5.7890 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 6.5430 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 7.8020 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 8.3110 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 7.5590 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 0.0220 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.4160 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 1.0960 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 2.0630 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 0.6530 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 2.2910 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 3.6890 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 3.9360 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 3.0710 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 3.2610 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 5.6960 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 5.4750 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 5.2600 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2530 9.8300 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4800 10.7250 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5830 6.9320 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3890 6.0020 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 4.8110 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 6.1520 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 8.3900 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 9.2980 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 7.9810 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 1.9170 1.0880 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0640 1.5900 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 51 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END