OTAVA-ZINC05486102 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0200 1.5090 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0210 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5230 -0.3760 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -0.5100 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -1.2170 2.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -0.5370 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.7520 3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -2.1210 4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -1.2820 4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 -0.0700 4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 0.3040 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 1.4930 2.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 2.3050 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.5330 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -0.2160 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -0.6490 1.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -1.4370 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -1.8040 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -1.3110 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -1.5930 -1.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -2.6220 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -2.9090 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -2.1490 -0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9750 -3.7510 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 -3.9900 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1170 -4.7770 -2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6530 -5.3280 -3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3540 -5.0950 -4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -4.3060 -3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.8900 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8630 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8640 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 0.3500 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -2.4080 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -3.0660 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -1.5750 5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 0.5820 4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 2.5520 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 1.7590 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 3.2220 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 0.4120 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -2.9940 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -3.5610 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1320 -4.9630 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3070 -5.9430 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -5.5280 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -4.1210 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M END