PUBCHEM-ZINC06928694 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -0.4360 2.6300 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.1760 2.1520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 0.1290 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -1.2410 2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -2.1100 2.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8680 -1.5820 2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -3.3740 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -4.4060 2.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -2.4900 4.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -1.7410 5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -0.6570 5.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -2.3310 6.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -1.6890 7.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -0.6100 8.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 0.2000 9.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 1.3990 9.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 2.1430 10.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 1.6910 11.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 0.4940 11.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.2410 10.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -1.3970 10.7490 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 3.0310 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 3.4010 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 2.3730 4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 0.6370 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 0.0250 4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -1.7670 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -1.1030 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -3.4080 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -3.2340 6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -2.4680 8.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -1.2610 7.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 0.0630 7.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -1.0700 8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 1.7560 8.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 3.0740 10.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 2.2700 12.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 0.1280 12.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -3.2250 0.9060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 39 -1 M END