PUBCHEM-ZINC03068835 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 0 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 0.0230 -0.6990 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0790 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.7800 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0760 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6730 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9960 -2.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -4.1950 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.0930 -0.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -5.4580 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -6.6840 -1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -7.8550 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -7.8400 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -6.6040 -4.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -5.4390 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -8.9890 -4.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -9.1560 -5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -10.3570 -6.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -10.6700 -7.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -11.9330 -7.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -12.3920 -6.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -11.4190 -5.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -13.7020 -6.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -14.0400 -5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -15.2760 -6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -16.1870 -7.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -15.8640 -7.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -14.6360 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -17.5140 -7.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2630 -17.8250 -6.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -18.3830 -8.0100 O 0 5 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 0.0240 -0.1540 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6100 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1240 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.6940 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -8.7950 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -6.5880 -5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -4.4960 -4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -8.3640 -5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -10.0290 -7.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -12.4810 -8.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -13.3320 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -15.5370 -5.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -16.5810 -8.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -14.3880 -8.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M END