IBS-ZINC00546287 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 1.6180 1.0520 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.0890 0.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4010 0.3480 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.0910 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -2.2790 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.9760 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -2.0000 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.7920 -1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -1.1520 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 0.1300 -2.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 0.0300 -3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -0.8340 -3.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 1.0090 -4.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 1.1760 -5.7770 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8490 0.8760 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 0.4010 -6.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.1350 -6.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -1.7650 -7.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -1.6230 -7.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 2.6690 -6.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 3.3450 -5.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 0.6870 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 1.8270 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 1.5280 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -1.4570 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.5900 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.9920 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -1.9350 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -3.4330 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -3.7880 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -2.5260 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -1.6550 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 0.8680 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 1.7420 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 0.6750 -6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 0.7260 -7.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -1.4850 -5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -1.4630 -8.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.8590 -7.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -1.4650 -7.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -1.2750 -8.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -1.2710 -6.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -2.7170 -7.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 3.0210 -7.2370 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 M CHG 1 44 -1 M END