IFLAB-ZINC03911691 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6960 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0580 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7740 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1830 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.8160 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -4.0650 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.7090 -3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.7500 -2.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -4.9080 -3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0730 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6680 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -6.3220 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -6.8400 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -8.3040 -1.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -8.9840 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -8.3850 -1.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -10.4900 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -11.0000 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -11.1820 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -11.6500 -3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 -11.9380 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -11.7540 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 -11.2920 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6600 -12.3980 -2.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4680 -12.6730 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1460 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.5830 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.7470 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1160 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -6.6430 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -6.7200 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -6.5190 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -6.4420 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -8.7830 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -10.8110 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -10.8880 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -10.9580 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 -11.7920 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6060 -11.9770 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 -11.1530 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -13.4340 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5910 -11.7610 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4450 -13.0320 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 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 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END