PUBCHEM-ZINC04799190 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 62 0 0 1 0 0 0 0 0999 V2000 -0.2050 -0.0740 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 0.2090 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 2.1240 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 3.1130 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 1.0350 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 2.2520 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 1.9290 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 3.1360 3.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6040 3.5070 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 2.7250 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 4.2050 2.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 5.3280 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 5.5480 1.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 6.2680 1.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7280 5.6390 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 7.2490 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4590 8.7320 2.1790 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 8.3580 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 6.9990 0.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 6.3650 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 5.2190 -1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 7.1020 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 7.1430 -2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 7.8080 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 8.4150 -4.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 8.3600 -4.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 7.7020 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6200 7.6410 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.9070 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 0.7970 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -0.3470 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 0.4530 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -0.6400 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 2.6530 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 1.3640 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 3.6480 -3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 3.8550 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 2.6160 -3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 0.2370 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 0.6480 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 2.5870 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 3.0820 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 1.5740 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 1.1050 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 2.3460 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 1.9440 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 3.5810 5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 4.0970 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 7.5310 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4900 6.8650 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 9.0510 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 8.4310 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 6.6620 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 7.8520 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 8.9340 -4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 8.8380 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 8.0270 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 8.2480 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 6.6100 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 1.4060 -1.4570 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4600 2.0770 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 60 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 60 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 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 27 2 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END