PUBCHEM-ZINC05138403 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 0 0 0 0 0 0999 V2000 0.9190 -0.5200 -2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.7310 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.8760 -1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 0.2040 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -0.0490 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 1.2440 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -1.8990 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -3.3990 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 -4.1990 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -4.7120 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 -5.4220 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8900 -5.6070 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5030 -5.0990 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -4.4090 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 -5.2660 0.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1210 -3.8710 1.5560 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -4.2840 2.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 -2.7840 1.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2940 -3.4890 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0800 -6.2770 -1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -0.4230 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -1.3650 -3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 0.3910 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -1.6330 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 0.1110 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 0.0100 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -1.7430 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 0.6320 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 0.8880 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -0.7600 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -0.4910 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 1.9680 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 1.6980 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 1.0490 3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -1.5050 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -1.7010 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -3.6180 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -3.7340 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -4.5630 -3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -5.8090 -3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -4.0280 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0410 -6.0360 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9350 -4.3570 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8990 -2.6450 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7590 -3.2110 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1870 -6.6370 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -1.1050 -0.6750 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6670 -1.6660 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 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 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END