CHEMDIV-ZINC00123511 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.1750 1.1770 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 0.3410 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -0.1560 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 0.1770 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 1.0170 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 1.5140 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -0.3790 0.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -0.0920 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 -0.7930 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -1.5130 1.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -0.5380 -0.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 -1.0360 -0.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3700 -2.0130 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2910 -0.0400 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9180 0.1030 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 -0.9580 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7840 -0.8360 4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 0.3550 4.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 1.4220 3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3590 1.2960 2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8650 0.5090 6.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 -0.3520 6.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1630 -1.1700 -1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 -0.4830 -2.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 1.5660 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 0.0750 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -0.8090 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 1.3040 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 2.1680 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -0.4530 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 0.9850 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9470 0.0020 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3490 -0.3370 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 0.9460 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 -1.8920 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9520 -1.6750 4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5780 2.3440 4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 2.1300 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1650 -1.9380 -1.5270 O 0 5 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 M CHG 1 39 -1 M END