PUBCHEM-ZINC05191460 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.1880 1.5300 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.0100 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.6020 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.4680 2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -1.1860 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -2.0350 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -2.1750 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -1.4550 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -1.4200 -0.6450 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7600 -0.6190 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3820 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 0.4550 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.6090 -4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 1.4740 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 1.6160 -6.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 0.9010 -7.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.0390 -6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.1040 -5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 1.0460 -8.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 1.8550 -8.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 0.3920 -9.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.2080 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -2.9440 4.1040 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -3.2570 3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -2.2270 5.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -0.3580 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.7710 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 1.9500 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 1.9510 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 0.1950 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.0820 4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -2.8400 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -0.8680 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 1.0090 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 2.0290 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 2.2830 -6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.5140 -7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.7690 -4.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 2.8880 -8.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 1.4630 -9.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 1.8140 -8.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.2200 -8.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.2400 -10.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 1.1490 -9.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -2.7280 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -2.9370 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -1.5460 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 0.0580 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -1.4430 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 0.0480 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -4.2680 4.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -4.8490 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 26 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 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 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 51 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 9 1 M END