PUBCHEM-ZINC03175949 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.0730 1.3930 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.0810 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.8140 -1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -2.1660 -1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -2.7850 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -2.0520 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -0.6990 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -2.7280 2.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -4.5090 -0.2620 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -4.8790 -1.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -4.7120 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -5.2990 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -5.2590 -1.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5120 -4.9330 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -4.2800 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -4.7680 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -6.6560 -1.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2330 -6.6470 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -7.6430 -1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -7.9730 -3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -8.8790 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -9.4550 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -9.1250 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -8.2160 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -10.4260 -2.1580 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0950 -10.7170 -3.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -10.9340 -1.1620 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4910 -7.0360 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -2.9650 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 1.5410 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 1.8940 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 1.8100 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -0.3300 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -0.1260 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -2.7760 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1580 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -3.7370 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -5.7870 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -3.3060 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -4.1830 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -4.1960 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -7.5230 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -9.1370 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -9.5750 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -7.9550 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -7.0650 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -3.0540 -2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -3.9590 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -2.4600 -3.7280 H 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 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 28 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END