PUBCHEM-ZINC06089556 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 0 0 0 0 0 0999 V2000 -0.0860 1.4090 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.1200 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -0.5690 -1.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -1.9010 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.6660 -0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.4260 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.7370 -3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -3.2020 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -3.2740 -4.0880 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -2.6650 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.4460 -1.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -2.7160 -1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -3.1520 -2.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 -2.4820 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -1.8700 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -1.6550 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6920 -2.0430 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 -2.6490 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 -2.8800 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7150 -3.4950 -1.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 -4.0150 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1480 -5.1350 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5770 -5.6790 -3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5310 -4.5520 -3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4650 -3.4330 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0370 -2.8890 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -1.0050 2.8930 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7330 -0.6620 3.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -0.8140 3.8100 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1450 -3.6110 -6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -3.8030 -6.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.5720 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.5590 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 1.8040 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 1.7660 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.7460 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -0.4780 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -0.5150 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -2.0980 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -1.5640 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 -1.8700 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1760 -2.9480 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -3.5800 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 -4.4070 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 -5.9380 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8580 -4.7430 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.0710 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6240 -6.4770 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5490 -4.9400 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2410 -4.1600 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7550 -3.8250 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1450 -2.6300 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7460 -2.4970 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9900 -2.0910 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.8310 -6.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -4.5460 -6.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -3.9190 -7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -4.6900 -5.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -1.6690 -5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -2.6150 -5.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -3.3750 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -1.6070 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 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 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END