PUBCHEM-ZINC00627069 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.2630 1.2460 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.2250 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.8250 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -2.1920 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.9780 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -2.3890 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -1.0080 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.4830 -2.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -1.0070 -3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 0.1350 -4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.0660 -4.8850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 1.6330 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 0.5130 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.3780 -6.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 1.6840 -6.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.9970 -8.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 2.0120 -8.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 1.7110 -8.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 1.4020 -7.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 2.3380 -10.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 2.6590 -11.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 2.5580 -10.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 3.2500 -12.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5520 4.0890 -12.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 3.8270 -13.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 4.2530 -14.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 3.8530 -15.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 2.9270 -14.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 2.2690 -13.4710 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2310 1.3940 -13.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 1.7370 -13.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 2.1200 -11.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 1.4620 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 1.8250 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 1.5880 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.2250 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -2.6410 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -4.0450 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -3.0180 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -1.6040 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -1.6660 -4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 0.6890 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -0.3210 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 2.2380 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 2.3150 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 0.0040 -3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 0.9510 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 1.6550 -6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 2.2220 -8.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 1.7200 -9.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 1.2090 -6.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 2.3190 -10.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 3.0950 -13.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 4.6910 -12.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 4.9060 -14.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 4.2010 -16.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 2.1430 -15.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 3.5000 -14.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 0.9660 -13.9400 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 M CHG 1 59 -1 M END