PUBCHEM-ZINC03752762 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.1580 1.5980 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 0.0810 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.5630 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -2.0860 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -2.5990 -2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -3.9610 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -4.8950 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -6.2710 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -6.6770 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -5.7780 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -4.3980 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -6.5420 -4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -7.8870 -4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -7.9370 -3.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -8.7900 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -9.1120 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -9.3310 -5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -10.5090 -6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -11.4900 -6.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -11.2810 -6.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -10.0950 -5.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -12.2910 -6.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -12.0620 -6.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -12.6780 -7.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -12.8600 -7.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -5.9640 -6.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -5.3620 -5.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -4.1020 -5.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 1.9340 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 1.9850 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 2.0380 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.2700 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.2190 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -0.2060 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -0.2580 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -2.4480 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -2.3940 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -4.5870 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -6.9920 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -3.6730 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 -8.5870 -5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -10.6240 -6.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -9.9080 -5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -11.9660 -5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -11.1890 -6.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -12.9350 -6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 -12.0840 -8.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -12.9040 -6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6470 -13.8230 -8.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -6.7220 -6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -5.1910 -6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 -6.1850 -5.5120 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 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 M CHG 1 52 -1 M END