PUBCHEM-ZINC06167714 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.0880 0.5220 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.8300 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.9530 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -2.2170 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -3.3910 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -3.2780 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -1.9930 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -4.4630 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -4.6600 0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -5.6050 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -6.7960 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -7.1650 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -8.4140 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -8.7190 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -7.7790 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -6.5340 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -6.2310 1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -4.9040 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -4.1180 1.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -7.6530 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -8.8340 0.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -9.4220 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -10.5240 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -11.1980 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -10.7870 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -9.7030 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -8.9980 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -7.8370 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -6.8500 -1.5370 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9370 -5.1980 -0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 0.8160 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.5160 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 1.2770 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -0.0700 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -2.2830 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -1.9030 -3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -4.7380 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.2260 -3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -5.3260 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -9.1750 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -9.6950 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -8.0150 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -5.8040 2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -7.1780 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -10.8560 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -12.0460 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5910 -11.3090 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -9.3990 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -5.9820 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -7.9020 -3.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 50 2 0 0 0 0 30 49 1 0 0 0 0 M CHG 1 29 -1 M END