PUBCHEM-ZINC05028962 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.2670 0.5830 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 1.7380 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 2.1390 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 3.0110 3.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 2.3260 2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 1.9240 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 3.4540 4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 4.8120 5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 5.2100 6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 4.2840 7.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 3.0000 6.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 2.5850 5.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 2.0660 7.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 2.5040 8.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 1.2840 9.6920 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4740 0.6100 9.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 1.7350 11.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 1.1900 10.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 0.0640 9.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 0.5990 8.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 6.5530 6.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 5.8110 4.1090 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8600 6.3010 3.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 6.1420 4.1910 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0780 -0.1130 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 1.4350 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 0.0800 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 2.6290 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 1.0680 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 1.2450 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 2.6730 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 1.4340 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 2.9960 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 1.3900 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 2.8180 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 1.1220 7.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 3.0360 9.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 3.1680 8.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 1.2990 11.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 2.8230 11.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6970 0.7870 11.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0810 1.9630 10.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -0.8460 10.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -0.1280 9.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 7.2220 5.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 6.8230 7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.0520 1.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 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 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END