PUBCHEM-ZINC05551890 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.7580 0.0610 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -0.2730 1.6170 S 0 3 0 0 0 0 0 0 0 0 0 0 -0.4000 1.4370 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.3240 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -1.7210 0.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4960 -1.8160 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -2.1320 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1960 -1.2750 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -2.9910 1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5320 -3.8130 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -3.6300 1.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3130 -4.4350 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.6290 1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -4.1900 2.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -3.4950 3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -4.2910 4.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -5.5630 4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -5.5220 3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -6.5720 2.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -7.7320 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -7.9220 4.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -6.8320 5.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -7.0120 6.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -2.1750 2.2260 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6270 -2.9510 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -3.3130 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 0.3480 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.8420 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 0.8660 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 2.1210 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 1.4950 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 1.7550 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -0.0950 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 0.4340 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -2.4140 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -8.6360 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -6.2030 6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -7.9530 6.6950 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 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 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 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 2 1 M CHG 1 24 -1 M END