PUBCHEM-ZINC06067684 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.2370 1.5840 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 0.0790 0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8630 -0.2120 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -0.4610 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 0.2940 -0.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5610 1.3370 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -0.1620 -1.5680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8680 0.7180 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.6790 -1.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7450 -1.7250 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -0.7340 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -1.0990 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -0.5700 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -0.6360 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -1.2720 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -1.1020 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -0.9060 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -1.8200 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -1.7410 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -2.5530 0.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -0.7350 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 0.5440 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 0.3510 -0.5710 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6620 1.6330 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 1.6960 -1.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 2.8650 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 2.8770 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5560 3.4820 -2.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 2.1410 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 1.7810 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 2.0270 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 0.6260 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -1.0850 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -0.1500 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -1.5370 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 0.2330 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -1.4840 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -0.6200 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -2.1830 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -2.2480 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -1.3340 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -1.9930 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -0.2640 -3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -2.6910 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 -1.2110 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 -0.4920 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 1.2200 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 1.0560 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 1.6600 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 2.5300 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 2.8610 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 3.7640 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 2.3220 -4.2010 O 0 5 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 9 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 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 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 53 -1 M END