PUBCHEM-ZINC05433380 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.5530 1.1700 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.0640 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3060 -0.9330 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -0.0400 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -1.2730 0.9450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -1.6490 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -1.6060 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -0.3310 -1.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 0.5530 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 1.6490 -2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 0.1610 -3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.4510 -4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -0.7690 -5.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -0.4650 -6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 0.1510 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 0.4710 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 1.2290 -3.0940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -0.8530 -7.9320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -1.9310 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -1.5580 3.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -3.1730 2.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3250 -3.0460 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -4.4220 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -5.6930 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -6.6470 2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -7.8050 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -8.0240 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -7.0900 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -5.9300 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 2.0970 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 1.1550 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.2000 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 0.7900 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 0.1170 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -0.9260 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -2.6400 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -1.7950 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -2.4020 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.6660 -4.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.2390 -6.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 0.3880 -5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -4.5050 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -4.3260 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -6.5050 3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -8.5430 3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -8.9290 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 -7.2700 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 -5.2220 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -3.3060 3.4530 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4290 -3.1380 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -2.5730 3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -4.2220 3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 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 18 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 49 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 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 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 M CHG 1 49 1 M END