PUBCHEM-ZINC03870829 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.4410 1.0970 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -0.6450 0.2670 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -0.5960 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 0.6190 -2.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 0.6860 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.5100 -4.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.6870 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -1.7970 -2.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -2.6830 -4.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -2.0730 -5.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -0.7610 -5.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -4.1140 -4.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9640 -4.2700 -2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -4.8430 -4.5650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4830 -5.7370 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -5.3520 -5.9270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0560 -4.5630 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -5.7330 -5.6570 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1390 -5.5970 -6.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -4.7630 -4.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -7.1500 -5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -7.4790 -5.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -8.2660 -6.3930 P 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 -9.6590 -5.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -7.3340 -6.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4700 -7.4970 -7.3430 P 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 -8.2490 -8.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -6.4100 -6.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -6.0690 -6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -4.0730 -4.7380 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1630 1.9230 -3.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 1.7280 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 1.4290 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 1.2140 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -2.6380 -6.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -7.2140 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -7.9020 -5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 2.7440 -3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 1.9770 -4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -8.0740 -7.5600 O 0 5 0 0 0 0 0 0 0 0 0 0 7.9340 -6.0590 -7.5800 O 0 5 0 0 0 0 0 0 0 0 0 0 8.3760 -8.2510 -6.3740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 23 40 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 28 29 1 0 0 0 0 31 38 1 0 0 0 0 31 39 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 40 -1 M CHG 1 41 -1 M CHG 1 42 -1 M END