PUBCHEM-ZINC02021984 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 -1.3270 1.0900 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.3980 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -0.6630 1.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7590 -0.1400 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -2.1740 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -2.4520 2.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -3.1430 3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -4.5710 3.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -5.3570 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -5.6850 4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -6.5100 4.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -6.7010 5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -7.2670 6.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -5.1140 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -4.4730 2.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -6.5630 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -7.0480 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -8.4240 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -9.2990 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -8.8020 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -7.4280 3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -2.0960 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -1.3640 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -1.9550 3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -2.3120 3.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -0.1130 2.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -0.3810 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 1.5740 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 1.2380 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 1.5950 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -0.8350 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -0.8740 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -2.6770 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -2.5950 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -3.0190 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.7020 3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -6.2880 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -4.8060 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -4.7650 5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -6.2300 5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -7.4950 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -6.0090 3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -6.3660 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -8.8150 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -10.3710 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -9.4860 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -7.0420 4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -0.2940 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -1.8620 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -2.8380 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -1.2230 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -2.6810 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -6.2740 6.0900 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8320 -1.5610 1.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 26 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 53 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 25 1 0 0 0 0 22 54 2 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 53 -1 M END