PUBCHEM-ZINC05845212 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.4630 0.7030 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.7120 0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -1.2030 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.5690 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -3.0720 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -2.2060 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -0.8340 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -0.3390 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -2.7410 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8900 -2.7530 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -2.3180 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0150 -2.5020 3.2120 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.0750 -3.0790 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1020 -3.5010 1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -3.3610 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -3.6850 -0.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5310 -3.3230 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 -3.5250 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0380 -4.7640 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -4.9480 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -3.9060 -4.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -2.6730 -4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 -2.4770 -2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -4.0920 -6.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -2.9780 -6.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 -2.0580 4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4430 -0.5780 4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4910 -0.1150 6.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 1.2680 6.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -1.7150 3.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 0.9620 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.2030 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.0240 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -3.2390 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -4.1340 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 -0.1600 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 0.7220 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9570 -3.2100 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -5.5760 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -5.9060 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.8650 -4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 -1.5170 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -2.1470 -6.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -2.6750 -5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -3.2610 -7.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 -2.6440 5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -2.1970 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 0.0080 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4220 -0.4390 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2330 -0.7000 6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5120 -0.2540 6.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8980 1.6300 7.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -1.5870 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 -1.4190 3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M CHG 1 12 1 M END