IBS-ZINC02401595 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 2.2840 1.3310 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 0.1170 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -0.9390 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -2.1560 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -3.3080 2.6280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1340 -3.5920 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.4960 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -4.6760 2.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -2.9620 4.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -3.2250 4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -2.3850 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -2.0910 4.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -2.1310 6.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1110 -1.6300 6.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -3.4600 7.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -1.3130 7.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -0.3740 7.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.5900 8.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 1.6150 9.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 1.6980 9.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 0.7130 9.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.3190 8.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 0.6980 9.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 1.6600 10.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 1.6400 10.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 2.7040 11.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 2.7450 10.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 3.8410 11.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 5.0190 11.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 4.5340 12.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 3.7010 12.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 1.0520 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 2.0730 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 1.8040 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 0.4350 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -0.3110 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -1.2550 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -0.4900 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -1.8390 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -2.5110 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -3.9870 7.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -3.3070 8.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -4.1170 6.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 0.5450 7.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 2.3350 9.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -1.0570 8.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 3.4100 11.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 4.2470 10.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 5.6280 12.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 5.6670 10.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 3.9310 13.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 5.3870 13.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 4.3700 11.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 3.1880 12.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -5.1310 1.1480 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 55 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 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 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M CHG 1 55 -1 M END