PUBCHEM-ZINC06248553 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 0 0 0 0 0 0999 V2000 -0.0280 1.5430 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 0.0130 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.4750 1.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.6300 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -1.9940 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -0.8530 1.0770 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -1.7730 2.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.1390 -0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 0.6100 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 0.8790 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 2.0250 3.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 2.9100 2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 2.6390 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 1.4840 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 3.5280 -0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 3.0570 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 1.8700 -1.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 3.9850 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 3.5010 -3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 4.3720 -4.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 5.7240 -4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 6.2100 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5670 5.3500 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 6.6530 -5.5010 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1610 6.2270 -6.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 7.8430 -5.2600 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3220 4.0700 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 4.9200 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6420 3.7420 2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 1.9170 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.9070 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8960 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.3600 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.3400 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.5620 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 0.1590 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -2.0620 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.7830 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -2.1090 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 0.1910 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 2.2310 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.2680 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 4.4820 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 2.4460 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5300 3.9990 -5.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 7.2660 -2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 5.7320 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 4.3700 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 5.8160 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 5.2060 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 3.1710 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 4.6620 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 3.1490 3.8770 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 6 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END