IFLAB-ZINC02711180 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3590 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.5080 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 0.1790 1.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -1.6620 1.8210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -2.5580 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.5470 2.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -2.4140 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -0.6400 0.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -1.9910 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -1.4440 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -0.8390 4.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -1.6270 5.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -1.0950 6.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -1.4330 7.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -0.5630 8.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -0.8730 9.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -2.0540 10.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -2.9240 9.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -2.6110 8.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -2.8610 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -2.9090 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.0740 3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -1.5490 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -2.1110 5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.0120 6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -1.5370 6.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 0.3590 7.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 -0.1940 9.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -2.2960 10.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -3.8460 10.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -3.2890 8.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M END