NCID-ZINC04758328 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3550 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.7220 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.0540 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 1.4080 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 3.4960 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 4.1780 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 3.5030 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 2.1400 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 5.9400 0.0100 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 6.3550 -0.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 6.3330 -0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -0.7480 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -2.0380 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 -2.7340 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -2.0540 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -2.7640 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 -4.1480 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -4.8340 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -4.1370 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -6.3140 -0.0850 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9830 -6.9270 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -6.9180 -0.0790 O 0 5 0 0 0 0 0 0 0 0 0 0 8.4460 -2.0420 -0.0880 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4640 -0.8240 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 -2.6670 -0.1000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1680 -2.0790 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.8750 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -0.5420 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 4.0330 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 4.0660 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 1.6280 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -0.9740 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 -4.6960 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -2.4680 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 6.3830 1.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -4.8090 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -5.0030 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 7.3420 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 36 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 25 1 M CHG 1 27 -1 M END