PUBCHEM-ZINC05599962 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.1750 0.7940 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.9190 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 1.3910 3.7480 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0150 0.9900 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 0.7500 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 0.1230 5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.5110 6.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.5290 7.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.1050 7.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 0.7480 6.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 1.5300 6.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 3.0200 6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 3.6200 4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 2.9180 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 3.6680 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 5.0750 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 5.7520 3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 5.0310 4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 3.0120 1.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5520 3.1490 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 3.6560 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 3.5270 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 4.3470 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 4.7970 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 4.6410 -2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -0.2810 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.0360 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 1.1120 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 1.2270 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -0.1720 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 0.1010 4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -0.9930 6.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -1.0200 8.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 0.1130 8.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 1.2330 5.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 1.3080 7.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 3.5440 6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 3.2650 7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 5.6710 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 6.8370 3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 5.5800 5.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 4.7200 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 3.2350 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 2.4760 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 3.8740 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 5.4190 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 4.0080 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 5.8650 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 4.3100 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 4.6330 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 4.0870 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 5.7140 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 4.4290 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 1.5050 1.2570 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7570 1.3220 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 4.1580 -0.9340 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2210 3.1490 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 54 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 54 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 56 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 56 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 56 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 54 1 M CHG 1 56 1 M END