NCID-ZINC05023208 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.2890 0.5490 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.7900 0.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4830 -1.6070 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -1.0290 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -1.0280 -0.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -1.2240 1.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -1.3120 1.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9850 -1.7410 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 0.0440 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 1.2990 0.4660 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 2.7270 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 3.9440 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 4.1230 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 5.2510 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 6.2080 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 6.0370 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 4.9100 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -2.1730 2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -2.3460 3.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -0.8190 -0.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -0.8840 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -0.9270 0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -0.8890 -2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -0.9510 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -0.9730 -3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 0.2210 -4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 0.2020 -6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -1.0100 -6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -2.2040 -6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -2.1870 -4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 0.7520 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 1.3730 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 0.5680 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -1.3540 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -0.0660 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 0.4520 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 2.4740 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 2.9490 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6330 3.3800 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 5.3820 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 7.0840 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 6.7820 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 4.7860 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.7980 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -0.0750 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -1.8550 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 1.1720 -4.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 1.1320 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 -1.0250 -7.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -3.1480 -6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -3.1270 -4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -2.5820 2.6290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 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 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 1 52 -1 M END