PEPTECH-ZINC02244131 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0010 1.4920 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.1240 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -0.6350 -1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -0.0080 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.3730 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 2.1090 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 2.1210 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 2.3530 -1.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0250 1.4050 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6470 3.1450 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 4.3980 -0.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 3.1130 -2.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 2.5750 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 1.3820 -3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 3.5770 -4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 3.1470 -5.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 4.3220 -6.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 4.0480 -7.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 3.7800 -8.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 3.5670 -9.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 3.6280 -9.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 3.9070 -8.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 4.1200 -7.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 4.4370 -6.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 4.5650 -5.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 4.8830 -4.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 5.0630 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 4.9300 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 4.6160 -5.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -0.8610 -0.6950 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8580 -1.5460 -1.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.8920 0.4930 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8730 2.0860 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.3490 -2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -1.7020 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 3.1830 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 3.0920 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 1.5980 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 4.1210 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 2.8310 -6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 2.2920 -5.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 5.2520 -6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 3.7410 -8.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 3.3520 -10.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 3.4590 -10.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 3.9560 -8.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 4.9910 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 5.3080 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 5.0800 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 4.5230 -6.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 2.4540 0.3830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M CHG 1 51 -1 M END