PUBCHEM-ZINC05670103 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 0.1600 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -0.4600 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8510 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6150 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9960 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -2.7480 -0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -3.1240 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.9730 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -4.5410 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 0.3610 -4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -0.2490 -5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 0.5620 -6.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 1.8770 -6.1710 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8720 2.4220 -5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.6910 -4.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 2.7410 -7.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 3.0230 -8.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 2.5500 -8.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 3.8740 -9.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 4.1380 -10.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 4.9360 -11.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 5.4750 -11.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 5.2180 -10.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 4.4270 -9.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 1.2370 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -2.3320 -4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -2.2290 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -3.7110 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -3.7200 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -5.6290 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -4.2230 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -4.2060 -3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -1.3240 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 0.1270 -7.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 3.4980 -5.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 3.6790 -6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 2.2420 -7.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 3.7180 -10.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 5.1410 -12.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 6.0980 -12.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 5.6410 -10.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3600 4.2310 -8.7770 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 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 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 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 16 1 M END