PUBCHEM-ZINC00778794 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.2020 1.5860 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 0.0740 -1.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1540 -0.3400 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.2680 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -1.7780 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -2.3690 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -2.0110 -0.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.5680 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -2.8860 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -2.4910 -1.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -4.3890 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -5.1930 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -6.6900 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -6.3020 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -4.8020 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -8.5420 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -8.9720 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -9.8920 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -10.3280 2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -9.8510 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -8.9390 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -8.5020 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -7.5990 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -7.2770 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 -10.1900 3.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3480 -11.1310 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 2.0390 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 1.8280 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 2.0530 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 0.1130 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 0.2240 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.2540 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -1.9920 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -3.4470 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -1.9650 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -0.1450 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -0.3560 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -4.6250 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 -4.9300 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -4.9330 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -7.2410 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -7.0210 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -6.6270 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -6.5800 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -4.2770 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -4.5030 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -8.8620 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -9.0030 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -10.2820 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -11.0390 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 -8.5810 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6110 -8.1760 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -6.7010 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 -6.6460 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2230 -11.2940 5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 -12.0940 4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -10.7410 5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -7.0410 -0.3120 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9600 -6.7710 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 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 15 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 58 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 23 24 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 25 26 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END