PUBCHEM-ZINC04684485 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.1710 1.6010 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.0750 -0.2630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6620 -0.3620 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.3770 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.9030 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -2.3630 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -1.9110 -0.2160 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4400 -2.2390 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -0.3850 -0.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8910 0.0520 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.0670 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -2.4990 -1.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -3.7860 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -4.4620 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -5.7330 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -6.3360 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -5.6610 -3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -4.3880 -2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -3.6660 -3.3540 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1960 -3.7780 -4.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -2.9580 -2.6470 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9220 -7.6280 -3.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -7.7820 -4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -6.8060 -5.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -9.1440 -4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -10.0510 -3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -10.0730 -2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -8.6620 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -8.4550 -1.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 1.9290 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 1.9230 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 2.0380 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -0.0490 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.0610 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.3400 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -2.2240 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -3.4500 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -1.9250 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.3710 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -0.2610 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 1.1540 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -1.9950 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -3.9940 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -6.2590 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.1300 -3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -9.0530 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -9.5720 -5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -9.6610 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -11.0610 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -10.6500 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -10.5280 -3.1260 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 9 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 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 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 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END