PEPTECH-ZINC04241534 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.1990 1.4470 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.0650 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.7020 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -0.7100 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.3750 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 0.0520 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 0.6920 -0.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.3490 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -1.1350 -3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -1.1200 -4.6860 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7410 -0.2250 -5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -0.9520 -4.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -0.0090 -2.8470 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6870 -0.2120 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 1.4510 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 2.0740 -3.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3690 -5.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -2.4770 -6.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -1.6860 -7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -2.0830 -7.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -3.1700 -7.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -3.7020 -5.8740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.9540 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.8940 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.6760 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.6110 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -1.7640 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -0.2330 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -0.3070 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -1.7900 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -0.5450 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -2.1420 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -0.7000 -3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -1.9170 -3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -0.5740 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -2.3310 -6.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -3.2670 -4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -0.8530 -7.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -1.5920 -8.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -3.6770 -7.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4740 1.8380 -3.2180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 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 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 41 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 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 M CHG 1 41 -1 M END