IFLAB-ZINC04272690 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.0020 1.4300 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0770 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.6760 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -0.8180 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.2200 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -2.9060 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -2.2150 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -0.8220 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -0.1280 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -2.9170 0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -2.0000 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 -2.8050 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3230 -3.8520 -0.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -4.7250 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -3.8450 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -4.0090 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4000 -4.8140 -2.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5180 -3.2720 -1.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7380 -3.5180 -2.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.8410 -4.5770 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7600 -2.6590 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 -1.4120 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5220 -0.3720 -3.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1900 -1.6270 -1.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9830 -2.9950 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9830 -0.6680 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5460 -0.9480 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3280 -0.0020 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5520 1.2260 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9920 1.5070 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2040 0.5650 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3180 2.1500 0.6920 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 1.8000 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.7940 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 1.7870 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.7560 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -3.9860 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -0.2900 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 0.9520 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -1.2910 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -1.4590 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2840 -3.2630 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1360 -2.1450 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 -5.3690 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -5.3360 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -3.2790 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -4.4750 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5050 -2.5800 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 -2.4060 -3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2830 -3.1830 -4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8500 -3.6140 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7990 -2.9870 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3720 -1.9060 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7670 -0.2190 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1680 2.4650 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7630 0.7860 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 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 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 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 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 M END