IBS-ZINC04879104 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.6180 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 0.1420 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4760 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8710 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.6360 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -2.0100 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.7520 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -4.1730 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -2.5340 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -3.7480 4.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -1.7950 5.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -2.4240 6.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 -1.7120 7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 -2.3730 8.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 -1.6120 9.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 -2.2320 10.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2890 -3.6160 10.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 -4.3970 9.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -3.7830 8.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -4.5990 7.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -4.9260 6.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -5.7510 9.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -6.4160 10.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9180 -4.2120 11.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4890 -3.3520 12.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2200 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 0.1180 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -3.7140 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -4.6420 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -4.4710 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -4.4890 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -0.8260 5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -0.6340 7.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -0.5330 9.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -1.6350 11.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -6.1960 9.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -7.4920 10.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -6.0700 11.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2370 -2.7100 12.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -2.7350 13.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9590 -3.9540 13.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -4.9850 7.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -5.5200 6.8090 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 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 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 47 48 1 0 0 0 0 M END