CHEMDIV-ZINC04971657 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.2500 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -1.8540 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -2.8850 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -4.2230 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -3.8330 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -2.4500 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -1.8510 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -2.6270 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -4.0060 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -4.6070 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6650 -4.9960 0.0620 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -6.2190 0.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 -4.1720 0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0650 -5.2400 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 -6.0950 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6610 -6.2980 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9570 -5.8070 -4.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7410 -7.0250 -3.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -7.2120 -4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0590 -7.8910 -5.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2010 -7.9670 -6.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2640 -7.3210 -7.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1500 -6.5740 -6.2660 S 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 0.5120 -0.3560 -0.8950 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 0.0090 -2.7950 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.8040 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.7920 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -4.8010 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 -0.7740 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -2.1570 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -5.6840 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2350 -4.2720 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -5.7450 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 -7.0620 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1580 -5.5890 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3040 -7.4170 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0090 -8.5080 -7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2030 -7.2630 -8.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 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 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 M END