CHEMDIV-ZINC06797030 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -4.0350 1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -4.7260 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -4.1350 2.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -6.2330 1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -6.7410 2.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -6.9450 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -7.5840 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -7.7880 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9790 -7.3560 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 -6.7530 0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -6.5380 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -5.7280 3.1860 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -6.9330 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 -7.4170 5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -8.3570 6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -8.8210 6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -8.3530 5.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -7.4020 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -6.9360 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -6.6940 4.1430 O 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -4.5080 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -6.5890 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -6.5880 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 -7.9140 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -8.2810 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -7.5120 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2410 -7.0570 5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 -8.7320 6.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -9.5540 7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 -8.7200 5.5850 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 2 7 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 26 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END