PUBCHEM-ZINC05601283 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.2620 1.6610 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 0.1550 2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.7020 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -2.1690 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -2.6730 1.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -2.7990 1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -4.2150 1.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5930 -4.5220 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -5.1180 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -5.6320 0.2040 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -5.9520 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -6.5440 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -7.9350 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -8.4850 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 -7.6510 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -6.2670 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -5.7150 -2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -4.4100 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -3.4620 1.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.2770 -0.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -1.0560 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -2.2400 -1.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -0.2600 -2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -0.2840 3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 2.0360 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 2.1110 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 2.0320 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -2.2840 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -6.0460 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -4.5960 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -6.6370 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -5.0160 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -8.5970 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -9.5630 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 -8.0800 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -5.6180 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -4.6330 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.7050 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 0.4160 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.9380 -3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.3220 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -1.3570 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -0.0080 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 0.2140 4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -5.4630 2.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 45 -1 M END