PUBCHEM-ZINC03752659 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -1.0860 -0.1570 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -1.4350 -1.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -1.9360 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -1.5900 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -2.1010 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -2.9700 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -3.3310 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -2.8200 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -3.2340 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -3.3350 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.8210 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -4.1360 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -4.6000 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -4.7350 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -4.4270 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -3.9760 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -3.6070 -0.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -3.6010 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -4.9570 1.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -4.8920 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -4.7770 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6360 -4.8070 4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 -6.0500 4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -6.1940 4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -6.1600 3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -2.9660 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -4.2020 4.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -4.7670 4.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 0.1780 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 0.5810 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -0.2120 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -0.9260 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6760 -1.8300 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -3.3780 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -4.0310 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -4.0260 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -5.0940 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -4.5400 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -3.9900 3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 -5.5920 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 -3.8510 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 -4.7790 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 -3.9090 4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 -6.9390 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4880 -6.0020 5.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -7.1350 5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -5.3830 5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -6.2350 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 -7.0460 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -2.3040 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -2.3910 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -4.4880 4.6120 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 26 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 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 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