PUBCHEM-ZINC06403257 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.9380 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -4.6080 -0.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -6.2600 -0.9600 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -6.5700 -1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -6.7200 0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -6.8280 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -6.9800 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -7.4250 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -7.7200 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -7.5700 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -7.1280 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 -8.2050 -5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -1.9990 1.2220 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7320 -1.3140 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -0.8860 2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -1.1870 3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -1.9100 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -2.3080 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6670 -0.7390 4.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -4.4510 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -6.7490 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -7.5430 -5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -7.8000 -3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9340 -7.0140 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 -9.2930 -5.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -7.8900 -5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 -7.7820 -6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -1.0830 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -0.3250 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -2.1620 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -2.8750 2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 -1.5070 5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -0.5760 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 0.1900 4.5040 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 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 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 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 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 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 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M CHG 1 20 1 M END