PUBCHEM-ZINC05599483 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 66 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2070 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7100 -1.9470 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0090 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.5210 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.0310 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -0.4570 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -0.8460 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -1.3340 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -0.8390 2.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -1.1990 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -2.0120 4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -2.3780 5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8200 -1.9370 5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -1.1240 4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 -0.7590 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6090 -0.6900 4.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3880 -1.1090 5.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7450 -0.5480 5.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8270 -0.1000 5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1830 0.4610 5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9840 0.0300 6.2940 N 0 3 0 0 0 0 0 0 0 0 0 0 15.0610 -1.4370 6.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3380 0.5890 6.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1720 0.1400 7.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3530 0.5050 7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2730 2.0330 7.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -2.3240 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.2980 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.3080 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.0990 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -0.3430 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -0.1600 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.6110 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.1690 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -0.3210 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 1.1200 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 -0.9820 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -2.4230 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -2.3580 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -3.0100 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 -2.2250 6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9020 -0.1300 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9200 -0.7560 6.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4450 -2.1980 5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6510 0.1080 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1260 1.5490 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5290 -1.7900 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6550 -1.7570 7.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0560 -1.8530 6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8060 0.2360 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2800 1.6780 6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2290 -0.9480 7.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1760 0.5560 7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7040 0.4940 8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3490 0.0900 7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9480 0.1850 8.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8050 2.3860 8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2780 2.4480 7.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6790 2.3530 6.6540 H 0 0 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 39 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 3 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 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 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 3 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 27 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 M CHG 1 3 1 M CHG 1 23 1 M END