CHEMBRIDGE-ZINC04870176 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.2200 1.2410 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.1470 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.7030 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.1180 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 1.5080 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 2.0660 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 2.2020 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 3.6260 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 4.1620 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 5.6840 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 7.6630 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 8.1250 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 7.9240 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3440 6.4800 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 6.0210 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -2.1590 0.1410 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3360 -2.8530 0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -2.6100 0.1440 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2130 1.6850 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -0.7680 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.3060 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 3.1390 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 3.9530 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 3.9980 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 3.7950 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 3.7340 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 6.0830 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 6.0810 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 7.7250 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6470 8.2480 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 9.1840 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0960 7.5720 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 8.5920 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4760 8.1960 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8680 6.3790 -2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 5.8270 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 6.5950 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 4.9590 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 6.2120 -0.1100 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6610 5.6760 0.6110 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 39 1 M END