PUBCHEM-ZINC05866674 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 62 0 0 0 0 0 0 0 0999 V2000 0.2080 -1.9250 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -2.0670 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.6220 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.2150 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -0.4720 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 1.0270 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 1.3050 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 2.7370 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 3.3450 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 2.4350 0.8850 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 4.7550 0.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 5.5890 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 6.2190 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 7.6100 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 8.1950 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 7.4070 -3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9720 6.0200 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 5.4320 -1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1590 8.1060 -4.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2040 7.3450 -5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 5.5240 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 5.6310 2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 5.5880 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 5.7150 4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 5.8890 4.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 5.9420 3.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 5.8290 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.6420 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.8770 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -1.1710 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -2.3680 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.8070 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.1450 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.5840 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.0990 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 0.7410 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -0.9610 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -0.9530 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -0.9480 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 1.4600 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 1.5340 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 0.9050 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 0.8340 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 3.3260 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 6.3660 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 5.0370 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 8.2520 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 9.2770 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 5.3660 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 4.3490 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 6.7770 -5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 8.0460 -6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 6.6880 -5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 6.5400 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 5.0430 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 5.4550 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 5.6840 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 5.9980 5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 5.9010 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -0.7340 1.8130 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3380 -0.0020 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 60 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 60 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 27 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END