PUBCHEM-ZINC05048734 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 1.4790 1.2180 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -0.2280 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -1.0870 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -2.4480 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -2.9800 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -2.1240 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.7550 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -2.7130 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -4.0710 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -4.8430 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -4.2960 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -6.2910 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -7.0540 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -8.4160 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -8.9920 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -8.1750 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -6.8510 -2.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -1.9160 -3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.9630 -3.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -2.3770 -4.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -1.8810 -5.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -2.5100 -6.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -2.0950 -8.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -1.0460 -8.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.3950 -7.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -0.8250 -6.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 0.7430 -8.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 1.3260 -7.2080 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0860 -3.3430 2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 1.3550 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 1.8360 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.5840 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -0.6950 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.0810 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -4.5140 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -6.6000 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -9.0200 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -10.0490 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -8.5740 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -3.1590 -4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -3.3330 -6.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -2.5880 -8.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.7290 -9.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -0.3140 -5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -3.8030 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -4.1270 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -2.7850 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 1.0310 -9.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 48 2 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M CHG 1 28 -1 M END