PEPTECH-ZINC04241983 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.7910 0.7650 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.2110 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.4270 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -1.4290 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.7530 -1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 0.0520 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 1.2590 -1.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -0.7070 -2.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -0.1950 -2.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6570 0.7550 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -0.0240 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 1.0090 -4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 2.3670 -4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 3.3190 -5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 2.9250 -5.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 1.5730 -5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.6210 -5.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 1.1460 -6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.7250 -7.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 0.3580 -8.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 0.3620 -7.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -0.0130 -9.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -0.4400 -10.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.9760 -11.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -1.1530 -12.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -0.1890 -13.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -0.5880 -14.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -1.9280 -14.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -2.8940 -13.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -2.5000 -13.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -3.2640 -12.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -2.4000 -11.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -2.8690 -10.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -4.2260 -10.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -5.0900 -11.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -4.6110 -12.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -1.2120 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 -2.4270 -2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 1.6800 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 0.3130 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 1.0590 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 0.6850 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.2540 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 1.3450 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -1.9360 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -2.1690 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -1.1470 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -1.7130 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4900 0.2590 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -0.9830 -4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 2.6900 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 4.3720 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 3.6810 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -0.4330 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 0.3140 -5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 1.9620 -5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 0.6860 -7.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -1.2060 -9.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 0.4340 -10.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -0.3360 -11.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 0.8500 -12.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 0.1470 -14.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.2160 -15.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -3.9250 -14.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -2.2050 -9.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -4.6180 -10.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -6.1440 -11.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -5.2870 -13.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -0.7130 -1.9780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 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 42 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 4 47 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 48 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 37 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 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 51 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 15 16 2 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 27 62 1 0 0 0 0 28 29 2 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 65 1 0 0 0 0 34 35 2 0 0 0 0 34 66 1 0 0 0 0 35 36 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 37 38 2 0 0 0 0 37 69 1 0 0 0 0 M CHG 1 69 -1 M END