IFLAB-ZINC05241661 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 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 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.6320 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -2.3800 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -3.2220 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -5.1240 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -4.2760 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -2.9170 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -6.5870 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -7.3230 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -7.1080 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -8.4820 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -9.0780 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -10.4260 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -11.3020 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -12.6660 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -13.2020 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -12.3590 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -10.9770 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -9.6600 -0.0330 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -14.5500 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -15.3610 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -14.8500 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -13.4850 -0.1140 O 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -2.8020 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -5.2340 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -4.6920 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.2620 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -6.5210 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 -10.8970 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -12.7740 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -16.3990 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -15.2840 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -14.9180 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -15.4480 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END