PUBCHEM-ZINC04223592 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.1600 1.2750 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -0.0730 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.6940 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 0.0300 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.3860 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 2.0040 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.6370 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -1.8730 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4740 -2.3430 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 -1.1940 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 0.0180 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 1.1600 -4.7670 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 0.0670 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -1.1660 -5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 -2.2770 -5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -3.1590 -6.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 0.4270 -7.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 1.6790 -7.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 2.7190 -7.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 1.7410 -9.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0380 2.8820 -9.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 2.9770 -10.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 1.9370 -11.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 0.8050 -11.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 0.7070 -10.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 2.0360 -13.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 2.1150 -14.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 0.3410 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 1.7580 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -0.6410 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -1.7500 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 1.9770 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 3.0550 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -0.0360 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -1.5970 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 -2.7310 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 -1.3250 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -2.8830 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -3.0440 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -0.3020 -7.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 3.6980 -8.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 3.8670 -11.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 -0.0040 -12.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 -0.1670 -9.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 0.9870 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 0.8180 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -0.9290 -1.3640 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2680 -1.4090 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 3 0 0 0 0 17 18 1 0 0 0 0 17 40 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 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 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 3 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END