PUBCHEM-ZINC05843340 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0460 1.6500 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 0.2560 1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.2280 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 0.7600 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 1.9170 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 3.1350 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 3.2140 0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 4.4680 0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0130 5.3000 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 4.8820 -1.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7190 5.7500 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 5.2890 -0.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 4.7900 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 4.7920 0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 4.2920 0.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 3.7740 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 5.2500 -4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 5.6510 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 4.5080 -6.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 3.5680 -5.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 3.0550 -4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -1.5470 0.3950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3910 -2.4610 0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -1.6810 -0.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6450 2.3680 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.3170 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 3.9890 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 3.8580 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 2.8850 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 3.5050 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 6.1180 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 4.7660 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 6.3340 -6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 6.1700 -4.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 2.7310 -5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 4.0350 -4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 2.5490 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 2.3900 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 4.2350 -3.3840 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1090 4.6960 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 39 1 M END