PUBCHEM-ZINC05825044 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -4.0580 0.0070 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8070 -4.8530 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -6.1700 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -6.1300 -0.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -6.8940 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -4.8130 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -4.2250 -2.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -5.8010 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -5.5350 -5.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -6.7790 -5.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -7.1850 1.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -6.9110 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -7.8340 3.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -5.6530 3.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -5.5010 4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -4.5980 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.4580 2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -8.5790 1.1540 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -6.3580 -3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -6.3820 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 -4.9780 -5.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -4.9550 -5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -6.6870 -6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -8.9120 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -9.2050 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -8.6590 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 6 1 M END