PUBCHEM-ZINC06266101 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.8530 1.5910 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 0.1330 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.6190 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -1.9180 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -1.9660 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.6870 -1.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -0.2890 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 0.4760 -3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 0.8680 -4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 0.5080 -5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -0.2590 -4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -0.6570 -3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 0.9360 -6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 1.6340 -7.0900 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4940 -3.1450 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -3.0300 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -3.0560 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -2.0010 3.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -0.8360 3.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.6130 4.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -3.9650 4.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -4.3120 3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -5.3770 3.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -4.8100 6.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -4.3190 7.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -5.1490 8.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -6.4870 8.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -6.9940 7.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -6.1640 6.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 1.7570 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 2.0920 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 2.0790 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -0.2430 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 0.7440 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 1.4550 -4.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -0.5410 -4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -1.2140 -2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -3.2060 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -3.1050 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -4.0820 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -3.9720 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -2.1330 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -3.2870 7.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -4.7470 9.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -7.1300 9.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -8.0390 7.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -6.6160 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 0.5660 -7.1190 O 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 48 2 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M CHG 1 14 -1 M END