PUBCHEM-ZINC03665681 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 2.2990 0.2220 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.7400 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.0320 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.9170 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -2.5620 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.2810 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -1.3700 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.0640 -3.1600 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -3.4450 0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -4.0810 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -2.2780 2.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -1.7130 3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.0430 3.9980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -2.6560 4.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -2.2330 6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.9950 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.7140 8.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 0.1480 9.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -0.6130 11.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -1.1980 10.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -2.0540 9.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -4.1150 4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -4.5030 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -5.0710 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 -5.1970 4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -4.7050 3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -4.2850 3.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -0.2830 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 1.0700 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 0.6270 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -0.5820 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -2.7560 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -3.3480 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -4.7180 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -4.7250 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -3.0750 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -3.0070 6.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -1.3310 6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -1.3850 6.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -2.9380 7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -1.5780 8.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -0.1180 7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 1.0430 9.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 0.4940 10.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 0.0560 11.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -1.4210 11.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.3830 10.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -1.8010 11.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -2.3750 8.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -2.9320 9.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -4.6280 5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.4390 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -5.3600 6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -5.6000 4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -4.5910 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -1.2420 8.2010 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3880 -0.4150 8.0280 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END