PUBCHEM-ZINC05157681 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 46 0 0 1 0 0 0 0 0999 V2000 -0.1460 1.4330 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.0960 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6960 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -1.6170 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -2.4350 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -3.3580 2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -4.1780 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -5.1010 3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -5.9230 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -6.8480 4.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 -7.6720 4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -8.5980 5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 -9.4090 5.7050 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1480 -8.7160 5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -10.2290 6.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8540 -10.7450 7.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 -10.0680 7.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3700 -10.4440 4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2770 -10.9800 4.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 2.0370 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 1.9500 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -0.4640 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -1.2920 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -0.0290 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -1.0200 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -2.2960 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -3.0340 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.7580 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -2.7590 3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -4.0340 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 -4.7750 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -3.5020 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -4.5040 4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -5.7760 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 -6.5190 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 -5.2490 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 -6.2520 5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -7.5220 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -8.2600 3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7330 -6.9980 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -7.9860 6.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 -9.2650 5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -9.6180 7.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -11.0690 7.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9230 -12.0910 7.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8810 -12.2860 7.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5330 -10.6390 4.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 47 -1 M END