PUBCHEM-ZINC05528878 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 67 0 0 1 0 0 0 0 0999 V2000 2.8060 2.3650 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.9450 0.7040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9660 0.6620 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 0.8520 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.1480 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -2.6030 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -2.7140 -1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -2.2620 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -0.7890 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 0.0360 1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -0.3940 1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -0.1280 1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -1.2620 3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 -1.6910 3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 -2.5560 4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 -2.9780 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -3.8220 5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -4.2140 6.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8390 -4.0980 6.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1880 -4.8380 7.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4260 -5.5940 7.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 -3.8750 8.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5350 -5.5270 7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6640 -7.6310 5.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6590 -8.3740 4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9920 -8.6570 4.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7420 -7.4560 3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8640 -6.6660 5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 2.4450 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 3.0850 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 2.6520 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 1.1870 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 1.4370 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -1.0790 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -0.5180 -1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -2.9830 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -3.2410 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.3950 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -2.8920 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.1540 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -0.4580 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -0.6910 3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -2.1460 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -2.2470 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -0.8020 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 -2.0030 5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -3.4480 4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 -3.5620 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 -2.0870 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0280 -3.0780 8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 -3.3850 8.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6250 -4.3980 9.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3120 -4.7710 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8380 -6.1900 7.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6470 -7.3640 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 -8.2260 6.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -9.3280 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1390 -7.7970 3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 -7.7410 3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2700 -6.8570 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3710 -7.2490 5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3820 -5.7160 5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.5950 0.2270 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9830 -1.1370 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4720 -6.3480 5.7390 N 0 3 0 0 0 0 0 0 0 0 0 0 10.0030 -5.7430 5.0470 H 0 0 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 4 1 0 0 0 0 2 10 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 63 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 63 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 63 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 65 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 28 65 1 0 0 0 0 63 64 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 63 1 M CHG 1 65 1 M END