OTAVA-ZINC04425560 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 1.6350 2.6310 3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 1.5720 4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 2.2580 5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 0.6780 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.6810 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -1.5060 3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -0.9660 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 0.4080 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 1.2180 3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -1.8380 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -1.7060 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 -0.8660 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -0.1610 4.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 -0.9340 3.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6210 -1.7290 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3160 -1.9520 2.5160 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -2.5010 1.5630 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 -0.1440 4.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7460 -0.4340 4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 1.3210 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 2.2570 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 3.6000 4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 4.0070 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 3.0700 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 1.7280 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -0.3940 5.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -1.1540 5.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 3.2780 4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 2.1420 2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 3.2280 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 0.9740 4.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 2.8560 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 1.5040 6.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 2.9050 6.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -1.0960 4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.5650 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 0.8320 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 2.2780 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -2.5850 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 1.9400 5.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7220 4.3320 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 5.0560 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 3.3880 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 0.9960 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 0.2270 6.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 0.0350 7.7350 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 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 45 46 1 0 0 0 0 M END