PUBCHEM-ZINC04115894 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 0.0310 1.5360 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 0.1380 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -0.6470 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 0.0440 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 1.4520 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 2.1870 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 3.6520 -0.1510 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2150 4.2630 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 4.1910 -0.3530 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6300 -0.6910 -0.4150 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6370 -0.0300 -0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -1.9260 -0.2850 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0920 -2.0300 0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -2.8230 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -4.3070 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -5.1990 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -6.6780 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -7.5800 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -9.0480 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 2.0890 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -0.3310 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 1.9650 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -2.5250 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -2.5720 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.6180 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -4.5540 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -4.5090 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -4.9560 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -5.0010 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -6.9180 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -6.8750 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -7.3400 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -7.3820 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -9.3410 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -9.2980 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -9.8800 0.8580 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3650 -10.8830 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -9.7150 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -9.6750 1.7610 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M CHG 1 36 1 M END