IBS-ZINC02409967 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 0.0490 -0.0780 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -0.9800 -0.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0600 -2.0060 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -0.6330 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -1.5950 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -1.7200 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.0370 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -1.0070 0.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -0.1220 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 0.5960 -1.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -0.0740 0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -0.5210 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 0.6830 0.6370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5190 1.6360 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8120 -0.1020 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -0.2880 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -1.0660 -2.5050 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 -1.1140 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 0.9630 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 0.2220 2.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -0.1970 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -0.3390 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.9810 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -0.6670 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 0.3900 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -2.5850 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -1.2540 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.5040 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -0.7770 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -3.0000 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -2.1570 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -1.0850 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 0.4290 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 0.6790 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -0.9410 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 -1.7180 -4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 -1.5640 -4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -0.1020 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 1.8850 2.0870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 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 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 M CHG 1 39 -1 M END