PUBCHEM-ZINC05651193 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.1060 1.7390 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.2300 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.4730 -0.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1040 -0.0870 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.1360 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -0.2700 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -0.6770 4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -2.1360 4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.7270 5.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -4.0740 5.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -4.8470 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -4.2550 3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -2.8900 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -2.2660 2.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3810 -2.5760 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -2.6740 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -2.0230 -0.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6900 -2.4300 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -3.9140 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -2.4690 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -6.1670 4.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -6.9760 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -4.7250 6.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -3.9850 8.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 2.1820 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 2.1990 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 2.0000 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 0.0590 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.1970 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 0.9430 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -0.5290 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -0.7170 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 0.8200 3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.0810 4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -0.4510 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -2.1080 6.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -4.8640 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -2.4390 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -3.7610 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -1.8890 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -2.1280 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -4.5270 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -4.2730 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -4.0820 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -3.4190 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -7.0810 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -6.5850 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -7.9740 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.6600 8.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -3.1610 7.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -3.6230 8.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.7410 2.4060 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3640 -0.4220 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 30 1 0 0 0 0 5 31 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 52 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 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 52 53 1 0 0 0 0 M CHG 1 52 1 M END