PUBCHEM-ZINC04557046 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.1100 1.5060 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.0090 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.7430 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -2.2100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -2.8530 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -2.8230 -0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.0590 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.6650 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 0.0100 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -0.6940 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -2.0880 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -2.7720 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -2.8890 -0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 -2.2620 0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2670 -1.5990 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -3.3690 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1750 -2.9190 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1400 -4.2380 1.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2380 -4.8610 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -3.3750 2.5230 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1110 -4.0020 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -2.3010 2.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1410 -2.7880 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 -1.5030 1.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -1.4320 3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -0.1770 3.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5250 -2.7990 2.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1260 -3.5510 2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2670 -5.1300 1.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2880 -5.5010 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 -4.2240 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 -4.3660 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 1.8650 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 1.9520 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.8850 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.3000 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 1.0960 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 -0.1150 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -3.8580 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 -2.0980 4.8010 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 40 -1 M END