PUBCHEM-ZINC01844813 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.4330 0.9140 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.4320 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -0.9470 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -0.1180 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 1.2370 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 1.7480 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -0.6900 -0.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5060 -1.7710 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -0.0710 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -0.1540 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 0.3950 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 -0.2980 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 -0.2240 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -0.7780 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -0.5220 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 0.4020 -1.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -1.4860 -2.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -1.4880 -3.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -0.3580 -4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 1.1160 -6.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 1.2790 -7.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 0.1570 -8.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 -1.0570 -8.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -1.3490 -6.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 1.3150 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -1.0790 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -1.9970 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 1.9070 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 2.8000 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 0.9900 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 0.4140 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -1.1970 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 1.4730 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 0.2680 4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 0.1660 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 -1.3480 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 0.8190 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -0.7850 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -1.8550 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 -0.6710 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -2.2060 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 -1.3990 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.4660 -4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -0.5520 -4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 0.6010 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 1.9420 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 1.0330 -6.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0860 2.1730 -8.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 1.3990 -7.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -1.8670 -8.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -0.9920 -7.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -1.4580 -7.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -2.2430 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -0.1780 -5.8100 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8320 -0.0780 -5.5010 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END