IBS-ZINC00546287 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.5340 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0120 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 0.1320 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -0.1410 -3.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.5780 -4.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 0.7350 -5.9700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4840 -0.0510 -6.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 0.6350 -7.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.7740 -7.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -0.8380 -8.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -1.7840 -7.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 2.0810 -6.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 2.8320 -5.0610 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -2.1570 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.3790 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 0.2050 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 0.7960 -4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 1.3630 -6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 0.8400 -8.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -1.0120 -6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.6000 -9.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -1.8420 -8.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -0.1180 -8.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.5460 -8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -1.7380 -6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -2.7880 -7.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 2.4450 -7.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 3.3180 -7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 44 45 1 0 0 0 0 M END