PUBCHEM-ZINC03766484 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -1.8900 -2.5850 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.1390 0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -2.9770 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -3.4960 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -3.3900 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -2.7580 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -2.2510 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.3600 2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -2.6640 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -1.7330 5.5880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0160 -2.4330 6.9530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3610 -1.7840 7.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -2.3810 7.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 -1.5900 7.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 -1.3140 7.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -1.0500 5.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -0.1810 5.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -3.0290 8.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -2.0220 10.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -1.8260 12.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -2.6960 13.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -3.6110 13.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -4.0710 14.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -3.7940 6.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -4.9740 6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -6.2060 6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -6.2760 6.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -5.1150 6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -3.8920 6.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.7790 7.0590 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -3.3440 4.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -1.5000 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.7790 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -3.0680 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -3.9830 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -3.8000 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.7720 4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -1.9510 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -3.7040 9.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -3.6310 8.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -1.4020 9.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -1.3750 10.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -1.2560 12.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 -1.1600 12.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 -2.0810 14.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -3.2750 14.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -4.9440 6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -7.1120 6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -7.2360 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 -5.1550 6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -0.9490 5.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 -2.7340 11.4130 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1430 -3.3690 11.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -3.3390 11.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 31 2 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END