PUBCHEM-ZINC05735012 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.3950 1.3860 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.1280 -0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7040 -0.6160 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.6660 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -2.1960 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -2.6830 2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -2.6610 3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -3.1030 4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -3.5720 4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -3.5920 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -3.1480 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -3.9750 5.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -4.4860 5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1260 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -1.0320 -1.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9490 -0.6630 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -1.1400 -2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -1.9740 -3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -2.0630 -5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -1.3080 -5.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -0.4510 -4.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 -0.3780 -3.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 0.5220 -4.9600 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 1.2600 -3.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 1.7120 -6.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -1.4070 -6.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.3160 -0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 1.6540 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 1.7780 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 1.9000 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -0.3230 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -0.2270 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.5620 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -2.6440 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.3030 4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -3.0830 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -3.9460 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -3.1710 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 -3.7200 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -4.7700 6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -5.3830 5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -0.3560 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 0.9390 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -2.5720 -3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -2.7250 -5.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 0.2770 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 1.2170 -6.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 2.4860 -6.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 2.1740 -5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -2.0910 -7.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -2.9580 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -0.4540 -0.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4040 -1.4820 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -0.0470 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END