PEPTECH-ZINC04242014 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.0720 1.1720 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.2150 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -0.7860 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 0.0550 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 1.4490 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.0140 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 2.0580 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 3.3840 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 3.6950 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 2.6880 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 1.3510 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 1.0490 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 -0.3180 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 -1.0150 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -1.6840 1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -2.3820 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -2.4190 3.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -3.0370 2.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 -3.9000 3.3920 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7820 -4.4090 3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 -3.0300 4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6980 -3.4980 5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7520 -2.3520 5.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4950 -4.9820 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9330 -4.6650 1.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 1.5950 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -0.8500 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -1.8590 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 3.0830 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 4.1710 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 4.7290 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4790 2.9530 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 0.5740 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -0.9280 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -0.3000 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -1.7760 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 -2.9610 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1840 -2.4960 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2880 -4.4490 6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6810 -3.2810 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 -1.3550 5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -2.5240 5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6760 -6.0370 3.3970 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 43 -1 M END