PUBCHEM-ZINC05490793 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.1010 0.8030 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.4920 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.0420 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -0.2640 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 0.0330 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 0.5690 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -0.8310 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -2.2040 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -2.7620 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 -1.9050 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -0.5310 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -0.0060 0.2000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6270 1.4130 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 2.2180 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 3.5850 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 4.1230 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 3.3000 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 1.9310 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 0.3640 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1200 0.4360 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2200 1.2830 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 2.0640 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3850 1.9890 -1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 1.1410 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 -4.2440 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -4.9400 -0.4410 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0600 1.2170 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 0.6600 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -0.2850 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.1540 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 0.7970 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -2.8530 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -2.3130 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 1.8040 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 4.2340 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 5.1900 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 3.7290 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 1.2930 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 -0.1710 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9780 1.3290 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2070 2.7220 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 2.5860 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 1.0910 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -4.6610 -0.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 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 32 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 2 0 0 0 0 M CHG 1 12 1 M CHG 1 26 -1 M END