PUBCHEM-ZINC05633247 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.5870 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -0.1750 0.1790 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -1.0220 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -1.1420 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 -1.6450 -3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -0.7440 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -1.1980 -5.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -2.5690 -6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -3.4720 -5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -3.0050 -3.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -3.0620 -7.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -2.2740 -8.3660 O 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 0.5290 -0.3650 0.8850 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 -1.4180 -1.6240 0.0070 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 0.1750 -0.7100 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -1.2550 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -0.1660 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -1.8430 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 0.3170 -4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -0.4930 -6.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -4.5350 -5.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -3.7030 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 -4.3860 -7.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -4.6610 -8.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 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 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 32 33 1 0 0 0 0 M END