PUBCHEM-ZINC05857439 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 0.4780 0.8130 6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -0.4620 6.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -1.1080 5.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.2640 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.7730 5.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -2.8590 3.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8810 -3.0240 4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -1.8540 2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -1.4870 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -0.5840 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 0.7340 1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 1.5540 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 1.0680 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -0.2370 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -1.0610 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -4.2990 3.2960 N 0 3 3 0 0 0 0 0 0 0 0 0 0.2040 -5.2600 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -5.3520 5.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -6.3920 6.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -7.3210 6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -7.2230 4.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -6.1810 3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -5.9020 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.4160 2.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5210 -4.1820 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -3.5330 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -3.9050 3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -4.8360 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -4.4550 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -5.8570 2.9890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3000 -6.6820 3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -5.1830 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.4750 5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 1.3440 7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 0.5910 7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -1.1270 7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -0.2240 6.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -2.2350 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.9250 2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -1.0130 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -2.3900 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 1.1340 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 2.5730 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 1.7070 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -0.6170 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -2.0810 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.6520 6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -6.4850 7.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -8.1230 6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -7.9430 4.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -6.5310 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -6.0910 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 -5.9090 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -4.4060 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -4.7070 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -2.2230 2.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -1.7730 2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -6.5140 1.8020 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7840 -5.8050 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -7.1300 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -7.0860 2.0760 H 0 0 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 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 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 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 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 28 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 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 58 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 56 57 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 58 61 1 0 0 0 0 M CHG 1 16 1 M CHG 1 58 1 M END