IBS-ZINC02122242 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 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 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1610 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -0.4470 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -1.8180 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.6120 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9960 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -2.7500 -0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -3.1280 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -4.0260 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -4.9730 -1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -4.1190 -3.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.7690 -4.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5820 -2.7100 -4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -2.5580 -5.8680 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -4.3510 -6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -5.0180 -4.9630 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2830 -5.1890 -5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -6.3320 -4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -6.5060 -3.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -7.3130 -5.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -8.5900 -5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -9.5220 -6.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -10.8350 -6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -11.0900 -6.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -12.2950 -6.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -13.2470 -5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -12.9950 -5.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -11.7900 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -11.5450 -4.9640 F 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 1.1150 1.2380 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 0.1580 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -3.7260 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -2.2320 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -3.7120 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -4.6270 -6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -4.6180 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -7.1740 -6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -9.0500 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -8.4180 -5.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -9.0620 -7.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -9.6940 -6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -10.3460 -7.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -12.4930 -7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -14.1880 -5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -13.7390 -4.6680 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 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 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 M END