PUBCHEM-ZINC00074013 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2360 1.5450 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.0050 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8560 -0.6080 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.1050 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -2.4110 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -1.9470 -1.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7970 -0.4470 -1.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7360 0.1270 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0600 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -0.2180 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 0.0920 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 0.7220 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 0.9460 0.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6900 -0.0020 1.2460 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9990 -1.0380 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 0.0150 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.3970 0.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5150 -1.4880 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 0.3600 2.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 0.3560 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 2.4320 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 0.5590 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 1.3090 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -2.9480 -1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -2.1560 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -1.1110 -2.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 1.8590 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 2.0880 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 1.8980 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.1170 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.3940 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -2.4520 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.6530 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -1.9240 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -3.4890 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 1.1460 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.3500 -3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 0.3530 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -1.2680 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 1.0700 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 1.0030 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.6710 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 3.0950 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 2.6740 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 2.7010 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -0.4580 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 2.3320 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7010 0.9030 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -2.8740 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.8200 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -3.9870 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -3.3590 -2.7210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 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 17 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 22 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 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 M CHG 1 52 -1 M END