PUBCHEM-ZINC06614424 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6160 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1360 -1.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0150 -2.4940 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.6330 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -2.0040 -1.3360 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -2.6680 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -3.4640 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -3.9830 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 -3.7110 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 -2.9200 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -2.4030 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8350 -2.6320 -0.4070 N 0 3 0 0 0 0 0 0 0 0 0 0 8.7550 -3.0920 0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 -1.9350 -1.3780 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1970 -2.6590 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -1.9430 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -3.9230 -0.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -4.4310 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -5.8800 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -7.7030 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -8.3410 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 -7.6660 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -6.6760 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.1820 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -2.2760 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -3.7230 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -3.6760 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -4.6010 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 -4.1180 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 -1.7890 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -4.4950 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -4.3870 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -3.8200 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -5.9240 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -6.4910 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -8.3220 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 -7.5630 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -8.1380 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -9.4160 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8550 -7.1300 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -8.4080 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -5.7610 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -7.1330 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -6.3900 0.3110 N 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 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 34 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 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 M CHG 1 15 1 M CHG 1 17 -1 M END