OTAVA-ZINC04745388 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.2030 1.4630 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 0.1730 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -0.5550 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 0.4600 1.4150 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 1.7840 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -1.9040 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -2.3020 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -1.4860 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -0.2740 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 -2.1170 -0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -3.4550 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 -4.4710 -0.5440 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -3.9580 -0.2900 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 -1.3650 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -1.2040 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -1.6710 2.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -0.5410 1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6580 -0.3840 2.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9700 0.4010 2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5070 0.5640 4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4340 1.2920 5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7680 2.0370 5.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5320 3.3700 4.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8850 3.4320 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5420 2.7020 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 2.1680 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.2270 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 2.7530 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.6200 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 -1.9050 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 -0.3820 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6330 -0.1670 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 0.1560 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8340 -1.3670 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7000 -0.1400 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7940 1.3840 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 1.1040 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6840 -0.4190 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6150 0.2590 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8000 1.7780 6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2400 2.0700 6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4230 1.5200 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7170 4.4740 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5140 2.9550 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8930 3.2100 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0700 2.6980 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7680 1.3180 4.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END