PUBCHEM-ZINC05821180 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 61 0 0 1 0 0 0 0 0999 V2000 0.2990 0.9560 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.3440 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -0.9770 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -2.2850 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -2.8940 0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -3.8330 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -5.2580 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -6.2370 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -7.6560 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -2.5440 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.7080 1.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -3.1850 0.7980 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0380 -4.1870 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 -2.2890 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2180 -2.9650 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9740 -2.1600 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -0.9620 -1.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -3.3260 2.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 -4.4370 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -5.4250 2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -4.4030 4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -3.2120 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 -3.2350 6.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4580 -4.4440 6.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 -5.6520 6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6800 -5.6170 4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 -6.9760 6.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 -4.4250 8.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 1.3920 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 0.7870 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 1.6870 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.0400 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.1450 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -0.2750 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.1660 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -3.0020 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.0910 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -3.8100 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -3.4900 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -5.2850 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -5.5740 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -6.2200 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -5.9310 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -8.0030 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -8.3390 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -7.7140 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2090 -1.3450 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -2.0150 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9610 -3.9380 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9100 -3.1500 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 -2.5620 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 -2.2600 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1830 -2.2950 6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5230 -6.5440 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7470 -7.0080 6.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -7.8080 6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1530 -7.1400 7.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0680 -4.8900 8.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 -4.9570 8.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 -3.4020 8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -2.8100 -2.3410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 2 0 0 0 0 16 61 1 0 0 0 0 18 19 1 0 0 0 0 18 51 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 M CHG 1 61 -1 M END