PUBCHEM-ZINC06169327 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -1.9550 1.4120 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 0.0040 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -0.6940 1.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2090 -1.7220 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -0.6900 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -1.1350 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.2160 3.7880 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -1.0790 4.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 1.0410 4.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 0.0290 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -0.6490 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.8140 -1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 0.0690 -2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -0.8280 -3.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -0.3380 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 0.8200 -5.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -1.1990 -5.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.6780 -7.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.7810 -7.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.6080 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 2.9740 -6.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 3.5270 -7.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 2.7160 -8.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 1.3470 -8.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 0.4800 -9.2820 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5450 0.9780 -10.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.7320 -9.1910 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0770 2.0450 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 1.6140 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 1.6220 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 0.3140 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -1.3900 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -0.8400 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -2.2110 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.4160 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.0910 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 0.4250 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 0.9180 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -2.2520 -5.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -1.3320 -8.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 1.1780 -5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 3.6140 -6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 4.5980 -7.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 3.1550 -9.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END