PUBCHEM-ZINC05650754 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.1180 1.5930 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.0650 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -0.4540 -0.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -1.8800 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -2.3210 -0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5590 -1.8310 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -3.8390 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -4.2370 -0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -5.5640 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9670 -6.0190 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2370 -7.3660 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 -8.2660 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -7.8100 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -6.4620 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -9.6340 -0.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -10.0380 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3590 -9.2220 -1.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -11.5030 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3010 -11.6880 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -13.4520 -2.1300 S 0 3 0 0 0 0 0 0 0 0 0 0 -10.3110 -13.4680 -3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -14.1160 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -1.9580 1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.9890 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 1.9720 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.9070 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -0.2490 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -0.3140 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -2.2350 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -2.2990 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -4.1250 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 -4.3300 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -5.3190 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 -7.7210 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -8.5100 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -6.1060 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 -10.2900 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -12.0490 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0460 -11.8840 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0800 -11.1420 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2200 -11.3070 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1800 -13.0420 -4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6670 -14.4950 -3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0400 -12.8770 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -13.9390 -3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7340 -15.1870 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7330 -13.6200 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -2.3590 1.9110 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 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 M CHG 1 20 1 M END