PUBCHEM-ZINC05553442 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 56 0 0 1 0 0 0 0 0999 V2000 0.1330 0.9180 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.5610 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -0.8910 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -2.3840 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -2.7850 -0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7170 -2.4950 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -4.3320 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 -4.8480 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -5.8140 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -6.3220 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9020 -7.3690 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2740 -7.9510 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -8.0840 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3760 -8.7980 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1020 -9.0880 -3.3050 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.4310 -9.5900 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3250 -9.9660 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5550 -7.8790 -3.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7760 -7.3410 -4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.1030 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -2.3740 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -1.8260 3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -0.9940 3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -0.7030 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -1.2360 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -0.8400 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -0.3520 -0.8480 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1640 1.1330 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.2190 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 1.5330 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -1.1480 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.8350 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -0.2890 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -0.6140 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -2.9520 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -2.6710 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -4.7730 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -4.7020 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -4.4110 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -6.2610 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 -5.8300 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -7.8720 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1580 -8.9420 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8630 -7.3450 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 -7.0890 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4260 -8.6520 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1990 -9.7440 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0100 -8.1740 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0410 -9.4740 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8490 -10.1480 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0460 -10.9310 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -3.0300 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -2.0560 4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -0.5700 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 -0.0500 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 -0.9980 0.2470 O 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 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 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 17 1 0 0 0 0 15 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 2 0 0 0 0 M CHG 1 27 -1 M END