PUBCHEM-ZINC02915601 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 -0.0060 1.6310 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 0.2110 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -0.4660 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -1.7420 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.3350 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -2.3140 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -3.5970 2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -4.1570 3.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -3.3800 4.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -2.0560 4.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -1.3750 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -0.1700 5.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -2.3190 6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -1.8770 7.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -2.6920 9.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -2.2960 10.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 -3.4620 11.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -4.5310 10.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -4.0630 9.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -5.9840 10.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -6.5970 11.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -7.9930 11.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -8.7980 10.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -8.2080 9.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -6.8070 9.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -9.0050 8.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -9.2500 7.4090 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5400 -10.5110 10.8000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -3.9090 6.2270 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -1.4180 3.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8850 -0.4970 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -1.0520 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 0.2810 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 0.6250 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -0.3490 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -1.6790 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -2.0280 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4230 0.1240 0.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 -0.8280 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.5280 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 2.1500 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 2.1920 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 1.6340 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -0.3050 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 0.2250 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -0.8160 7.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -1.2730 10.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -3.5070 12.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -6.0020 12.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -8.4460 12.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -6.3680 8.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 1.0670 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 1.6640 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -2.4720 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -3.0740 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7920 -1.3060 1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 -1.5720 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2930 -0.2920 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -5.0700 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -5.2670 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -4.0060 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -9.3230 7.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 62 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 52 1 0 0 0 0 34 35 1 0 0 0 0 34 53 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 54 1 0 0 0 0 37 55 1 0 0 0 0 38 39 1 0 0 0 0 39 56 1 0 0 0 0 39 57 1 0 0 0 0 39 58 1 0 0 0 0 40 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 M CHG 1 27 -1 M END