PUBCHEM-ZINC05962507 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.1380 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 0.1590 3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 0.5310 4.6210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6390 0.0330 5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.0360 5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -0.4840 7.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.8630 8.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -0.8010 8.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.3580 6.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -0.3170 6.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -0.1070 5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 0.0550 5.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -0.0760 4.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5600 7.0260 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5080 -0.2270 6.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -0.9550 8.0250 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5030 2.0540 4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 2.5140 3.5580 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 2.4060 5.8400 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 2.6340 4.7390 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 0.2600 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.2080 9.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -1.0970 8.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -0.4410 7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 3 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END