PUBCHEM-ZINC03738175 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 -0.0770 -1.8050 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -1.0550 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -2.3920 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -3.2110 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -0.0970 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 1.3570 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 1.3800 2.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 2.5900 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 3.8300 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 5.0110 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 4.9750 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.7220 5.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 2.5340 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.2730 5.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 1.1640 6.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 6.2450 5.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9930 6.0180 6.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 7.3310 5.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 8.6710 4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 9.3590 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 10.7050 4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 11.0610 3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 10.0740 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 8.7330 3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 8.4050 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 7.1820 4.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 6.3160 4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 12.4870 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 9.1850 5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 8.1710 6.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -2.8670 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -1.7440 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.3860 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -0.0150 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -1.5020 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -2.2090 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -2.8950 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.6510 3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -3.5200 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -4.1220 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -0.2680 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -0.3660 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 1.9720 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 1.7180 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 3.9140 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 5.9600 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 3.6900 6.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 1.6480 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 0.1000 6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 1.5660 7.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 11.4630 4.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 10.3460 3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 7.9800 3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 12.6600 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 12.7210 3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 13.1790 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 9.3570 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 10.1420 5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 8.4100 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 8.1220 7.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -1.0330 1.3180 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6750 -0.5840 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 6.7820 5.5610 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2530 6.1180 6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 6.7850 4.6050 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 34 1 0 0 0 0 2 35 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 61 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 63 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 63 1 0 0 0 0 61 62 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 M CHG 1 61 1 M CHG 1 63 1 M END