PUBCHEM-ZINC05820743 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 0 0 0 0 0 0999 V2000 -0.9290 1.2610 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.2530 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.6740 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -2.1870 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -2.6080 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -4.4060 -2.5060 P 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -5.1150 -2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -4.9330 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -6.4570 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -6.9000 -5.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -8.4240 -5.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -8.8660 -6.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -4.7580 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -4.1610 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -2.8980 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -2.2940 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 -2.9460 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -4.2040 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -4.8150 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 -2.2960 -0.8240 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5890 -1.1880 -0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 -2.8700 -1.2450 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0290 1.7700 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 1.5300 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 1.5610 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -0.5220 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -0.7620 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -0.4040 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -0.1650 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -2.4560 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.6960 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -2.3580 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.0830 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -4.6160 -4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -4.4800 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -6.7740 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -6.9110 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -6.5830 -6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -6.4460 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 -8.7410 -4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -8.8770 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -9.9520 -6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -8.5490 -7.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 -8.4130 -6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -2.3880 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -1.3110 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 -4.7120 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -5.8000 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 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 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END