NCID-ZINC04409142 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.2240 1.1460 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0460 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.4960 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 0.2450 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 1.4390 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 1.9010 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 3.0830 1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 3.5060 2.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 4.6810 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 5.4400 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 6.6370 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 7.1220 4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 6.4010 4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 5.1760 3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 4.4600 3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 4.9480 4.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 6.1540 5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 6.8800 5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 8.0560 5.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 4.0370 5.1610 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 4.9750 5.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 3.2150 4.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 8.2990 4.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -0.3380 -2.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -1.0880 -1.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.8780 -3.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -1.7770 -1.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2900 -2.0790 -1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -2.5290 -1.5660 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5310 1.4990 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -0.6300 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 2.0160 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 5.0900 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 7.2060 3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 3.5220 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 6.5200 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 8.8270 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 9.0710 4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 3.0960 6.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 0.8790 -2.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 0.6680 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 2.5440 6.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END