CHEMBRIDGE-ZINC04199979 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 -0.6210 -1.6950 -6.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -3.8180 -6.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7800 -3.7020 -6.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -4.0260 -8.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -5.2010 -8.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -6.4600 -7.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -6.2010 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -5.0880 -5.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2590 -5.3530 -6.0310 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 -1.6930 -5.1820 -3.4220 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 -1.3760 -3.1270 -8.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -4.2750 -8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -4.9180 -8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -5.4130 -9.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -7.2230 -8.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -6.8270 -7.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -5.8950 -6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -7.1010 -5.6910 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