CHEMBRIDGE-ZINC01175748 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0350 1.4460 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.0600 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.7550 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -2.1640 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -2.7750 -0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.8500 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.2200 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -0.8140 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -0.1580 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -0.8850 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -2.2770 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -2.9430 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -4.4490 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -2.9860 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -3.5080 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -3.2110 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -3.7420 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 -4.5700 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -4.8680 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -4.3350 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -4.6490 0.0450 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9660 -5.3750 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6210 -4.1820 -1.0180 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.4290 -5.1500 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -4.7090 5.9910 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.7380 -4.7310 5.2330 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 -6.5460 4.9010 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -0.0220 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 1.8110 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8370 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 1.7800 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 0.9210 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -0.3780 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -4.8450 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -4.8170 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.7750 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -2.5650 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -3.5110 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5250 -5.5160 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1220 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -0.6060 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 0.9480 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 34 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 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 39 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 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END