CHEMDIV-ZINC04129070 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.5370 3.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 3.4710 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 3.0240 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 3.4760 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 4.9990 4.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 5.4930 6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 6.9510 6.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 7.6100 7.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 6.9960 8.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 9.1110 7.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5020 9.3930 7.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 9.7300 6.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 10.0310 5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 10.5880 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 10.8440 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 10.5490 5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 9.9960 6.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 9.7050 7.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5620 9.7060 7.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 9.4390 8.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 9.6000 8.6790 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9090 9.0260 9.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 11.0570 8.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 11.5250 9.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 12.9040 9.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 13.5550 8.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 12.3980 8.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4790 8.9820 9.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 11.3840 2.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 11.6200 2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 10.8850 2.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 10.5980 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.5140 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.0030 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 1.0920 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 1.2160 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 4.5590 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 3.0480 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 3.3460 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 3.4700 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 3.0260 5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 3.1920 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 5.2830 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 5.4490 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 5.2090 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 5.0430 7.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 7.4420 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 9.8330 5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 10.7460 5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 10.8780 10.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 13.4140 10.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 14.6280 8.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5340 8.9200 9.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 7.9980 10.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 9.6870 10.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 12.0520 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 10.6770 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 12.3100 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 10.8830 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 11.1610 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 9.5310 3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 3.0020 3.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 67 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 2 67 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 68 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 4 68 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 67 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 6 68 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 50 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 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 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END