IFLAB-ZINC04939755 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 1.4490 1.8580 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 0.5710 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -0.5270 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -0.3050 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 0.9680 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 2.0440 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 3.2770 0.9690 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -1.3480 1.7860 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -1.8640 0.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.3260 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -1.6660 -0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -3.8340 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -4.2650 0.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1280 -3.9840 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -5.7980 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -6.0470 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -3.5680 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -3.6250 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -3.8110 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -3.7530 -2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0760 -3.9490 -4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8330 -5.2660 -4.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4370 -5.5050 -4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -5.3960 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 2.7150 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.4630 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 1.1170 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -2.5410 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -4.2700 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -4.2040 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -2.6550 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -4.4410 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -2.7070 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -4.4530 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -4.6800 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6170 -2.9130 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5370 -2.7280 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7840 -4.4690 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1590 -3.8260 -4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7230 -3.2100 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3260 -6.5150 -5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0460 -4.8020 -5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 -6.1220 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -5.5290 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -6.5370 0.9970 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4970 -3.5900 -0.8170 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0960 -2.6490 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -4.2560 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9050 -4.0070 -3.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5340 -3.3110 -3.6740 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 9 10 1 0 0 0 0 9 28 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 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 46 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 49 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 45 -1 M CHG 1 46 1 M CHG 1 49 1 M END