CHEMDIV-ZINC01218712 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.7800 0.7850 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.6490 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -1.3700 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.6790 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -3.2590 0.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.4730 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -1.1910 -0.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -2.9720 -1.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -4.5160 -2.3270 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -4.6040 -3.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -5.4670 -1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -4.5730 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -3.6730 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -3.7330 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -4.6980 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -5.5910 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -5.5300 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -4.8700 -1.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -4.1410 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1100 -3.1510 -2.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 -4.6640 -1.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5660 -4.6300 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6840 -3.6960 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0770 -4.2120 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3460 -5.5010 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2900 -6.5630 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8930 -6.1080 -1.8780 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8400 -6.1480 -2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9700 -7.2180 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -6.8300 -0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 0.8700 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 1.2040 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 1.3800 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.9370 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -3.3170 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -2.2870 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -2.9360 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -3.0320 -2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 -6.3550 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -6.2360 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4240 -5.6860 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5840 -2.7460 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5590 -3.4650 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8900 -3.4950 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3770 -5.8170 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 -6.9230 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6190 -7.4110 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 -8.3660 -1.8250 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 M CHG 1 48 -1 M END