IFLAB-ZINC01239047 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 2.0160 1.4270 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 0.0520 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -0.6820 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -0.0310 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 1.3440 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0880 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 3.5550 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 4.2440 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 3.7100 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 2.5190 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 4.6190 0.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 5.9130 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 7.2330 0.4490 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 5.9990 0.2470 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 4.2140 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 4.1890 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 4.4800 -2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 3.8430 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 3.8410 -2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 2.7890 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8800 2.7870 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4320 4.1670 -4.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3360 5.2190 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 5.2210 -3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.0380 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 1.9960 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -0.4590 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -0.6060 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 1.8480 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 4.0860 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 4.9240 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 3.2200 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 3.6050 -3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2560 3.0250 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 1.8060 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 2.0380 -4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0380 2.5510 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2740 4.4030 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7640 4.1660 -5.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 6.2020 -4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 4.9830 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 5.9700 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7120 5.4570 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -2.4090 0.8690 H 0 0 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 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 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END