IBS-ZINC05091035 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.1930 1.6620 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 0.1510 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5290 -0.3650 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -0.2000 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 0.1240 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -0.2210 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -1.4860 -4.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -1.8030 -5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -0.8540 -5.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 0.4110 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.7290 -4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -0.2870 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.0510 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -0.4670 3.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.3240 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 0.1320 4.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.7340 6.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0960 -1.7960 6.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 0.0760 6.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 1.5470 6.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 1.9130 6.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -1.3200 8.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.9520 9.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -1.5010 9.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -0.8620 10.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 0.0390 11.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.0240 10.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.1770 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.9740 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 1.9110 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.3830 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -1.2620 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.4590 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 1.1860 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -2.2270 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.7910 -5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -1.1020 -6.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 1.1520 -5.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 1.7180 -3.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -1.3470 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 0.2920 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 1.0080 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -0.6310 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -0.1430 7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1910 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -1.1590 8.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.3680 8.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -2.2790 9.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -1.0600 11.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 0.6980 12.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 2.4500 6.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.4800 7.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 0.4970 7.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 3.3820 6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 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 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 52 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END