PUBCHEM-ZINC06350824 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -1.6830 -0.4940 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.1970 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.8000 -1.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7380 -0.4640 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.3500 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -2.8330 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 1.0800 -2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.5600 -4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 2.4410 -3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 2.7930 -4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 2.2980 -6.1700 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4810 1.4320 -6.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 0.9950 -5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 0.1350 -5.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2650 0.9430 -7.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 3.0490 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 2.9680 -2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 4.3950 -2.3600 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 5.0860 -3.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -0.0090 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -1.5690 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -0.1120 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 0.8900 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.5700 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 1.0270 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 1.7420 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 3.4590 -4.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 2.5890 -6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 1.1770 -8.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -0.1370 -7.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.4230 -8.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 2.5050 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 4.0790 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -2.9270 0.0640 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3280 -0.2740 -2.4120 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7510 -0.9460 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.3940 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 3.9780 -2.3200 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.2450 5.0710 -1.0990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 35 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 11 1 M CHG 1 14 -1 M CHG 1 34 -1 M CHG 1 35 1 M CHG 1 38 -1 M CHG 1 39 -1 M END