PUBCHEM-ZINC05178630 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 55 0 0 0 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 -4.6520 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -6.1820 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -6.7120 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -8.2190 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -8.8090 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.5850 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 4.1150 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 5.6450 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 6.1740 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 7.7040 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 8.2340 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 9.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 10.3300 0.0140 O 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -4.3010 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -4.2910 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -6.5340 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -6.5430 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -6.3600 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -6.3510 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 3.9460 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 3.9370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 3.7540 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 3.7630 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 6.0060 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 5.9960 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 5.8130 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 5.8230 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 8.0650 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 8.0560 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 7.8720 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 7.8820 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 -8.9060 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 10.4270 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 11.3920 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 -9.8700 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 19 54 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END