PUBCHEM-ZINC03766484 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -4.2280 -2.0010 -5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -2.3690 -4.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -2.3850 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.7550 -3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -2.8160 -3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -2.4970 -4.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.1350 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -2.0770 -5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -2.5830 -4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -1.7720 -5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -0.2760 -5.7130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9710 0.1150 -5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -0.0020 -6.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -1.1520 -7.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 -1.2680 -8.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -2.2900 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -3.5930 -7.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 1.3370 -7.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 1.7740 -6.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 3.7520 -6.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9570 5.2650 -6.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 5.5370 -6.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5230 6.5090 -6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 0.3280 -4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -0.1900 -3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 0.4250 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 1.5660 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 2.0950 -2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 1.4780 -3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 2.0190 -4.5590 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -3.2720 -3.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -0.9770 -5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -2.7100 -6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -2.0360 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -3.0020 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -3.1120 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -1.9150 -6.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -1.7970 -6.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 1.3270 -8.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 2.0340 -6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 1.7870 -5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 1.1240 -7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 3.3660 -7.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 3.4520 -5.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 5.7910 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 5.6140 -8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 -1.0810 -4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 0.0060 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 2.0370 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 2.9830 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -3.5890 -7.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8370 3.1560 -7.3490 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7650 3.2180 -8.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 3.8390 -6.9800 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 2 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 1 0 0 0 0 17 51 1 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