CHEMBRIDGE-ZINC02164711 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 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 6.2240 -4.6800 -0.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3510 -6.0330 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -6.8370 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 -8.2120 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -8.7870 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7380 -7.9880 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 -6.6120 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 -5.7570 -0.1180 N 0 3 0 0 0 0 0 0 0 0 0 0 9.9260 -6.2660 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7070 -4.5440 -0.1110 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 4.2380 -6.3880 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -8.8380 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 -9.8620 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7190 -8.4390 -0.1190 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 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 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 21 1 M CHG 1 23 -1 M END