CHEMDIV-ZINC06781442 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 1.3170 1.2150 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 1.1490 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 2.9550 3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 3.1900 4.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 4.5040 4.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 5.6540 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 5.7240 5.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 6.9270 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 6.8730 3.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 8.0840 5.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 9.4300 4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 9.6670 5.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9310 9.1490 6.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 11.1300 5.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 12.1560 4.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 13.4780 4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8830 13.7390 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 12.7850 6.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 11.5140 6.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 8.5720 4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 7.6560 3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9000 8.2830 2.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 8.6070 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 9.5750 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 0.1580 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 1.8550 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 1.4140 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 1.8280 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 0.1140 5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 1.2300 5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 3.1450 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 3.6040 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 2.4570 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 3.0940 5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 4.6070 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 7.9780 5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 10.0950 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 9.6600 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 11.9550 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 14.2840 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 14.7520 6.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 10.7880 7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 9.5060 4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 8.0660 5.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 6.7010 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 7.4350 4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 7.6840 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 9.0750 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 9.7790 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 10.5040 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 1.5170 3.8570 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5320 0.8950 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 8.9410 4.1550 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2160 8.0220 3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 51 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 53 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M CHG 1 53 1 M END