PEPTECH-ZINC02572732 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -1.2180 1.2350 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 0.3840 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 1.2090 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -0.7400 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -0.3020 -1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 0.3910 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 1.6090 -2.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -0.5010 -2.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -0.1320 -2.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1620 0.8680 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -0.0920 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 1.0060 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 2.3400 -4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 3.3740 -5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 3.0650 -5.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 1.7380 -5.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 0.7110 -5.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 4.1460 -6.2650 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3700 5.2930 -6.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 3.8540 -6.5770 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9500 -1.1360 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -0.9080 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 0.0300 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 2.0950 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 0.6480 -3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 1.6220 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 1.5930 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 0.6050 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 2.0700 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -1.3770 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -1.3950 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -0.3460 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -1.4790 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 0.0710 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -1.0610 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 2.5800 -4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 4.4020 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 1.4860 -6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -0.3190 -5.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -2.1700 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -0.9730 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -1.6960 0.0940 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 4 1 0 0 0 0 2 5 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 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 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 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 18 1 M CHG 1 20 -1 M CHG 1 42 -1 M END