PUBCHEM-ZINC06303470 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -1.4380 1.7450 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 0.2200 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -0.1650 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 0.5180 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -0.3020 3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.4060 3.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -1.3140 3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.0780 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 0.7330 5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 0.9240 5.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 0.6430 5.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 1.5420 7.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2720 0.9080 8.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 1.5080 8.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 3.0160 8.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 3.6340 7.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 3.0460 7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 3.7540 7.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 -0.1240 8.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -0.8330 9.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -0.2460 10.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -0.9560 10.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -0.2800 11.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -0.9920 11.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -0.3240 12.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 0.8410 12.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.7890 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 2.4400 2.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 2.2400 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 2.0380 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 2.2490 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -0.0510 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.2970 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -1.0460 4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 0.4320 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.7230 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 0.2170 6.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 1.0790 8.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1240 1.2450 7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 3.2540 9.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5860 3.4480 8.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 4.7160 7.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 3.4600 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 1.3750 7.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -0.8400 8.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -1.8850 9.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -0.3290 11.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 0.8260 10.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -0.9460 9.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.0060 10.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.2610 12.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 0.7650 11.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -1.0410 10.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -2.0240 11.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 1.8630 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 3.3350 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -1.0320 12.7310 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 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 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 17 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 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 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 57 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M CHG 1 57 -1 M END