CHEMBRIDGE-ZINC02164717 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2070 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0310 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 2.1780 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6280 3.3960 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 1.5860 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -2.0600 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -2.6240 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 -4.1530 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -4.7170 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 -6.2460 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -6.8100 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 -8.2380 -0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 -8.9000 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0070 -8.1900 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 -8.8650 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2300 -10.2480 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0440 -10.9580 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8360 -10.2870 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5670 -11.0470 -0.1080 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5860 -12.2650 -0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -10.4550 -0.0950 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -2.4080 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.3990 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 -2.2760 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4890 -2.2840 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -4.5000 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -4.4920 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 -4.3690 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8530 -4.3770 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -6.5940 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -6.5850 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2010 -6.4620 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2180 -6.4700 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 -7.1100 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1400 -8.3130 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1730 -10.7740 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0610 -12.0380 -0.1460 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 24 1 M CHG 1 26 -1 M END