IBS-ZINC02230373 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 58 0 0 1 0 0 0 0 0999 V2000 0.0260 1.5030 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0270 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.5410 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -0.7970 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -1.2680 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -1.4900 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -1.2300 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.7650 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -1.5650 -4.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8820 -2.6580 -4.8890 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8430 -3.2770 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -1.8900 -5.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9190 -2.1020 -4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.4020 -5.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9670 0.0980 -4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -0.6380 -7.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 0.1650 -7.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 0.2850 -6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -2.3450 -6.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -1.9830 -6.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -3.2100 -6.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -3.4690 -6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -4.2220 -6.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -3.8080 -8.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -3.4980 -9.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -4.0880 -10.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -4.9860 -10.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -5.2960 -9.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -4.7140 -8.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -2.0260 -5.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -2.3920 -6.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -1.9550 -4.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.8480 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 1.8760 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.8750 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.3990 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.3720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -0.6260 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -1.4650 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -0.5710 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -1.6990 -7.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -0.2480 -7.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 1.1550 -7.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -0.3810 -8.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -0.2260 -6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 1.3330 -5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -2.7970 -9.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -3.8480 -11.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 -5.4460 -11.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -5.9980 -9.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -4.9600 -7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -2.1980 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -0.3980 -5.5650 N 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 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 53 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 52 1 0 0 0 0 M END