PUBCHEM-ZINC03870143 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.8220 0.6000 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.2240 0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.3280 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 0.4380 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 1.2490 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 1.3660 1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 1.8850 -0.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 1.4180 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 0.5510 -1.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 2.8840 0.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0400 3.8570 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 2.8790 2.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6360 3.4190 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 3.5460 2.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2630 3.2970 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6490 2.9260 1.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9460 1.9090 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 2.7520 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8850 3.6960 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6410 2.8170 -0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9270 3.3850 -0.9550 P 0 0 3 0 0 0 0 0 0 0 0 0 9.6390 4.5690 -1.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4560 2.0410 -1.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9290 2.3610 -2.2550 S 0 0 0 0 0 0 0 0 0 0 0 0 12.5360 1.0380 -2.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6850 3.0150 -3.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 4.9550 2.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 5.8290 3.5040 P 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 5.6750 4.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 1.5470 2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 1.2610 2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -1.1700 -1.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 0.6490 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 1.7540 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 4.5840 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 3.9800 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -1.6850 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.2490 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9630 3.6550 0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5580 3.2120 -1.2310 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2740 7.2370 3.0620 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5910 5.1330 4.3490 O 0 5 0 0 0 0 0 0 0 0 0 0 11.8850 3.6510 -0.1750 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 33 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 30 31 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 39 43 1 0 0 0 0 M CHG 1 40 -1 M CHG 1 41 -1 M CHG 1 42 -1 M END