PUBCHEM-ZINC06883339 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.0950 0.9030 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.1960 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -0.5590 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 0.2130 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 0.4440 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 0.7180 -1.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 0.9540 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 1.2390 -2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 1.4990 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5810 1.4760 -2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 1.1910 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 0.9310 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8670 1.7470 -2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8650 1.7140 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2420 2.0350 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4350 2.2820 -3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2320 2.0080 -1.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6580 2.2900 -1.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9390 1.9280 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9840 3.7820 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4440 4.7320 -2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7040 6.1860 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0780 4.4660 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5170 1.5540 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8550 1.1930 0.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 1.1000 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.8390 1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 0.6080 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -1.0890 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 0.2980 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -1.3750 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -0.8890 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.5660 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 1.1180 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 1.3000 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -0.4580 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 1.2600 -3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 1.7200 -4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 1.1620 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 0.7140 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6520 2.4670 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 0.7140 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0440 1.7430 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5870 4.1060 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0730 3.9190 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3590 4.6100 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 6.8780 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2230 6.4130 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7760 6.3850 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8290 3.4690 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7180 5.1880 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1690 4.5470 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7390 1.4020 -0.5290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 M CHG 1 53 -1 M END