CHEMBRIDGE-ZINC04199980 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.4520 1.4290 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.0240 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -0.5360 1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -1.6760 1.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -2.1830 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -1.4830 3.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -3.5860 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -4.3520 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -5.6630 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -6.2280 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -5.4840 3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.1600 3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -3.4260 4.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -4.0770 5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -0.8620 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -2.2160 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -2.9960 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -2.4380 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -1.0910 -3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -0.3040 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -3.2330 -4.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -2.7590 -5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -1.5980 -6.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -3.9620 -6.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0680 -4.3410 -6.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -3.8970 -7.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -5.2980 -8.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -6.3830 -7.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -6.3300 -6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -4.9440 -5.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9710 -4.7240 -5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -4.5580 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -5.2770 -3.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 2.0330 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 1.5630 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 1.7410 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -3.9160 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -6.2540 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -7.2570 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -5.9310 4.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -3.3800 6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -4.9370 5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -4.4130 5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.6500 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -4.0420 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -0.6610 -4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.7430 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -3.6370 -7.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -3.1600 -8.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -5.3070 -9.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -5.5140 -8.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -6.2520 -7.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -7.3580 -8.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -7.0780 -5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -6.5000 -6.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 32 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 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 M END