PUBCHEM-ZINC06079814 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 1.0780 1.9510 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 0.6130 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -0.3060 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 0.1500 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 1.4850 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 2.3920 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 1.8670 0.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -1.7580 -0.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9660 -2.3330 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -2.4530 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -2.7730 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -3.4490 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -2.7120 -5.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -3.3950 -6.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -4.7330 -6.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -5.4210 -5.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -4.8340 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -2.4600 -2.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.7300 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -3.1440 -2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -2.3790 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -2.5210 0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -1.8720 0.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -1.4680 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.0590 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 1.4530 3.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 1.6360 5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.6770 6.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 0.4580 5.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.2060 4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 2.6480 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 0.3020 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -0.5290 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 3.4340 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 2.7920 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.6340 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.8690 -7.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -6.4940 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -5.4430 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -2.7650 -3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -2.1910 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -1.5400 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 0.7200 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 0.0790 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 1.3610 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 2.2730 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 2.5850 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 0.8340 5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 0.5480 6.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -0.3710 6.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 1.0130 4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.7570 4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 0.1700 3.5870 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5830 -0.6040 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END