OTAVA-ZINC06143915 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.5460 1.0460 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.4800 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 2.8020 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 3.6530 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 5.0070 -0.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 6.1780 -0.6210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5810 6.1780 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 7.4100 -0.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3860 6.7940 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 5.3060 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 4.5430 1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 7.3670 1.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 8.5390 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 8.7460 1.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 9.3760 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 10.0810 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 10.8470 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 10.9210 -2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 10.2290 -2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 9.4580 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 11.6940 -2.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 11.7890 -4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 6.0780 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 6.0840 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 5.9990 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 5.9060 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 5.8950 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 5.9800 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 5.7950 1.2940 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.0320 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 1.3870 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 1.5670 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 0.7570 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.5680 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 0.6590 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 3.1260 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 2.8650 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 3.7160 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 3.1880 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 7.7810 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 10.0320 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 11.3870 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 10.2700 -3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 8.9510 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 10.8080 -4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 12.2590 -4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 12.4290 -4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 6.1650 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 6.0140 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 5.8310 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 5.9840 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.3320 -0.0030 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2760 1.0470 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 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 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END