PUBCHEM-ZINC06051283 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 56 0 0 1 0 0 0 0 0999 V2000 -0.5960 1.3990 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -0.1230 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.6040 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -2.1260 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -2.6060 -2.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1310 -2.2470 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -2.0610 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -2.5600 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -4.1360 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -4.5980 -3.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -5.9110 -3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -6.7100 -3.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -6.3860 -5.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2250 -5.6890 -5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -6.4590 -6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -7.0310 -7.7140 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -7.0520 -9.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -6.6740 -8.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -6.6920 -9.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -7.0850 -11.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -7.4620 -11.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -7.4410 -10.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -7.8820 -12.6800 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3420 -7.8960 -13.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -8.2140 -12.8970 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9540 -7.7150 -4.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -8.7440 -4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -8.5690 -4.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -10.1100 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 1.8590 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 1.6820 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 1.7410 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.4060 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.5830 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3210 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -0.1440 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -2.4080 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -2.5850 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -2.4060 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -0.9710 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -2.2230 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -3.6500 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -2.1640 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -4.4920 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -4.5250 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -3.9580 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -7.1560 -6.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -5.4710 -6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -6.3680 -7.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -6.3980 -9.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -7.0980 -11.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -7.7310 -10.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -7.8550 -4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -10.0730 -4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -10.4260 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -10.8220 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 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 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END