PUBCHEM-ZINC06091709 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.1450 1.5960 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 0.6040 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -0.3000 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.1910 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 0.8160 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 1.7040 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 0.9290 -2.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -1.0870 -0.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -0.6700 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 0.4670 0.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7050 -1.5960 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 -1.1580 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 -2.0460 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 -3.3280 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 -3.6910 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4620 -2.8390 -0.7250 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2710 0.1090 0.2820 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5990 -1.3620 1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.5510 3.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -2.6070 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -3.2520 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -4.3510 5.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -4.8040 4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -4.1770 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -3.0830 3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.2860 1.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -2.7680 5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -1.8090 5.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 2.2900 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 0.5250 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 2.4850 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 0.3490 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -2.0100 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 -1.7400 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 -4.0400 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 -4.6920 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -3.1240 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -4.8510 6.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -5.6560 5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 -4.5410 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -3.3890 6.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -3.0350 7.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 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 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 16 1 M CHG 1 17 -1 M END