PUBCHEM-ZINC06438479 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 0.0130 1.3300 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 0.1740 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -0.2660 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 0.4470 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 1.6130 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 2.0520 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 2.3820 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 1.9980 -1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 3.5080 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 4.1740 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 5.5600 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 6.2190 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 5.4940 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 4.1030 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 3.4490 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 6.1990 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8200 5.6310 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7650 6.6230 0.4170 N 0 3 0 0 0 0 0 0 0 0 0 0 12.1140 6.7000 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6320 7.9110 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3210 9.0830 0.6200 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1420 7.7780 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7840 7.5630 0.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 8.2400 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -0.0340 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -1.2130 -2.9900 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 0.9450 -3.2640 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 -0.2800 -1.4890 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 1.6700 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -0.3870 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -1.1680 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 2.9540 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 3.8560 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 6.1200 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 7.2960 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1860 3.5390 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 2.3720 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0240 4.5730 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7360 5.8180 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6850 8.1430 0.6130 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 18 1 M END