NCID-ZINC05542770 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1820 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3690 1.7350 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 2.1560 -1.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 3.4570 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 4.3720 -0.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0170 4.6360 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 3.5460 0.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 5.6310 -0.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9000 6.2280 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 6.4520 0.6050 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2470 5.8550 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 7.7110 1.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1040 7.4480 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 8.6520 1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 9.9780 1.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 9.8440 0.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7340 9.9610 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 8.5120 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 10.8730 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 10.4990 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 11.4430 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 12.7600 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 13.1330 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 12.1900 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 12.5910 1.1250 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7500 13.7530 1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 11.7600 2.0140 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4620 6.8260 -0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 5.2570 0.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -0.6940 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7040 -1.9120 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -0.0700 -0.0440 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 3.4860 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 3.7300 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 8.4340 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 8.5520 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 9.4700 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 11.1510 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 13.4970 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 14.1620 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 7.3600 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 4.7220 1.3330 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 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 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 34 51 1 0 0 0 0 35 52 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M CHG 1 36 1 M CHG 1 38 -1 M END