PUBCHEM-ZINC00538278 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.0740 1.4240 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.0390 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6810 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.0330 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 1.4260 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 2.1280 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 1.8150 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 0.6730 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -0.4050 -0.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 -1.8060 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.4990 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -4.0140 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -4.4840 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 0.6250 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5810 2.0410 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 3.0880 -0.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1700 2.7890 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 3.1770 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 4.4100 -0.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 5.0510 -1.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2350 6.2550 -0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 3.9900 -1.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 5.5510 -2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 6.7460 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 7.1500 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 6.3630 -5.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 5.1780 -5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 4.7670 -3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 6.7560 -6.0720 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 1.9600 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -0.4950 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -1.7630 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 3.2090 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -1.8510 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -2.2810 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -2.2840 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -2.1180 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 -0.0240 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 0.2170 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 2.3190 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 2.0330 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 3.7740 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 3.6910 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 4.8460 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 7.3610 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 8.0720 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 4.5860 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 3.8440 -4.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -4.6260 -2.4200 O 0 5 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 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 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 49 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 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 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 49 -1 M END