PUBCHEM-ZINC03869571 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.2160 1.4460 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.0040 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.7940 1.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8220 -0.9000 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.1450 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.2180 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.7730 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -0.3890 -2.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.2390 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 0.1900 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 0.6570 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 0.6730 4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 0.2430 4.4260 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8220 -0.1910 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 0.2280 5.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5980 -0.5740 5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 1.5840 6.3000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2990 1.6080 5.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 1.5200 7.8430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3440 0.8000 8.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 1.1080 8.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5460 1.0900 9.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -0.2480 8.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3800 -0.9860 8.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -0.1600 6.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -0.8100 8.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -1.1350 8.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 2.0960 8.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 2.4260 7.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.8060 8.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 3.3940 7.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 2.6230 6.0790 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7310 1.9160 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8100 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.7070 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -2.1900 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.9820 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -2.7970 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.6300 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 0.1670 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 1.0020 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 1.0250 4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.5090 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -0.9560 10.1030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 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 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 32 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 30 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 13 1 M CHG 1 32 -1 M CHG 1 44 -1 M END