PUBCHEM-ZINC04102253 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.1070 1.5240 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 0.0510 -0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7630 -0.8550 0.9460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7970 -0.4770 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.9710 2.4010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6830 -0.3720 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -2.4680 2.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0720 -3.0190 4.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -4.2340 3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -5.0820 4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -4.2640 2.6010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5540 -2.7990 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -5.0970 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -4.7080 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -3.2040 1.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9180 -3.1310 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -2.2940 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -2.6370 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -1.5810 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -1.8700 -3.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -0.1270 -1.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0750 0.3130 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 0.5430 -1.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -4.6850 2.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -0.3900 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -1.1650 3.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -0.2900 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 0.2970 0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 1.8390 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 2.1890 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 1.7030 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -3.3010 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -2.2890 4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -4.9420 5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -5.9250 4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -2.1850 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -2.6630 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -6.1670 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -4.9760 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -5.2330 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -5.1050 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -3.6560 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 0.3510 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -5.6380 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 0.8060 3.6960 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8190 -1.1130 -1.1030 O 0 5 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 3 1 0 0 0 0 2 21 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 45 -1 M CHG 1 46 -1 M END