PUBCHEM-ZINC05386445 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 0 0 0 0 0 0999 V2000 0.0010 1.3590 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.0090 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -0.3650 -0.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 0.7980 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 1.8550 -0.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 0.9010 -0.5180 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1650 -0.0110 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 1.9020 -1.1030 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8230 -1.7370 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -2.1870 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -3.6220 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -4.0810 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 -5.5170 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -5.9790 4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -7.4160 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -7.8810 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -9.3190 5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -9.7870 7.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 -11.2240 7.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1940 -12.8920 8.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 -13.2740 9.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -13.5020 10.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 -12.3260 10.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 -11.8880 9.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 2.0110 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -0.7350 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -2.3660 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -1.8360 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.5160 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.1190 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -4.2940 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -3.6870 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -3.4100 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -4.0140 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -6.1860 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -5.5830 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -5.3110 4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -5.9110 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -8.0830 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 -7.4830 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 -7.2150 6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -7.8130 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -9.9850 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -9.3850 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 -9.1220 7.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -9.7080 7.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -11.9360 6.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 -11.2970 6.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 -12.6580 7.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -13.6830 8.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1630 -14.2010 9.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 -12.4980 10.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -12.5610 11.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 -11.5290 11.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -12.6680 8.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -10.9560 9.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -11.6460 8.5230 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8740 -10.8860 8.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 9 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 8 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 6 1 M CHG 1 8 -1 M CHG 1 57 1 M END