IFLAB-ZINC04315736 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3890 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6880 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -0.6550 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 0.0750 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 1.4820 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 2.1500 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4360 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.1070 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -0.6280 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -1.8430 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 0.0780 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 -0.6190 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 0.4070 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2640 -0.4540 -0.1110 S 0 0 0 0 0 0 0 0 0 0 0 0 12.3590 0.9270 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7190 0.8610 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2590 0.0550 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1840 2.1650 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0890 2.9680 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9990 2.1900 -0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5970 2.5990 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9130 3.9590 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2330 4.3580 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2450 3.4120 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9380 2.0600 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6210 1.6500 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5370 3.8080 -0.1670 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -1.7350 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 2.0360 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 3.2300 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 3.1860 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 1.0480 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6210 -1.2480 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 -1.2390 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5890 1.0370 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6060 1.0270 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0950 4.0480 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1240 4.6970 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4780 5.4090 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7310 1.3270 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3830 0.5970 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END