PUBCHEM-ZINC04472500 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.0970 -2.2680 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -3.4280 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -2.8960 1.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -2.6010 3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.7240 3.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -2.1180 4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -1.7030 5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.5590 5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.1350 5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -1.1330 5.7830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -1.5580 7.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -1.8490 7.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -2.3090 8.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -2.4800 9.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.1970 9.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -1.7330 8.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -0.7360 5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 0.7140 5.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 1.3520 6.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 1.3010 5.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 2.6720 5.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 3.5410 5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 4.8940 5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 5.3840 5.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8870 4.5220 6.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7130 3.1690 5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2540 5.0610 6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -2.1560 3.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -2.6360 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -2.8050 1.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -1.6690 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -2.6630 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -1.6460 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -4.0270 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -4.0500 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -1.4810 6.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.8450 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.5310 8.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -2.8370 10.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -2.3350 10.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -1.5170 8.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -0.8740 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -1.3510 5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9830 0.7730 4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 3.1580 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 5.5690 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9510 6.4430 6.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 2.4970 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7800 5.3190 5.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8190 4.3030 6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1500 5.9510 6.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.8890 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 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 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 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 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 M END