IBS-ZINC02129741 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.9510 -0.7000 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.0220 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 1.4960 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.3920 1.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1410 -0.1160 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.8760 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -2.3090 1.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -2.7240 1.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -4.1540 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -4.8860 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -6.3800 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -7.1000 2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -6.4820 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 0.3270 1.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 0.2210 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 0.8260 1.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 1.6180 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 2.2690 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 3.0650 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 3.2290 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 2.5970 4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 1.7880 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 1.0940 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 1.2020 3.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -0.3480 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.4520 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -1.7800 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.3580 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.8430 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.9740 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 1.7510 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.3860 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -4.5520 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.3000 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -4.4880 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -4.7400 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -6.7780 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -6.5250 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -0.3980 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 2.1480 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 3.5680 4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 3.8580 5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 2.7290 4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -8.4290 2.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -8.8470 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 44 45 1 0 0 0 0 M END