OTAVA-ZINC06142398 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2180 -0.6720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 0.0430 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.4430 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 2.1020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 1.9930 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 3.1930 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.1300 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -0.3950 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -0.9860 -1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -1.0000 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 1.4570 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 1.6850 1.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0770 2.4480 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 2.1470 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5780 2.4800 2.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 1.5880 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4680 0.2370 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0430 -0.4190 4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3100 0.2550 5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0010 1.5940 5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4200 2.2680 4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 3.6600 4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4710 3.7320 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9790 4.9440 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 6.0600 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 5.9880 4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 4.7930 5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5090 7.4040 5.9370 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.0340 -0.5880 7.0990 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 0.4650 2.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.8990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -1.7510 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 3.1820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 0.6330 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 2.3620 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7820 1.3490 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2460 3.0290 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2640 -0.2980 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2870 -1.4680 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2090 2.1180 6.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 5.0110 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 6.9980 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 4.7390 6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -0.2610 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 31 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 46 1 0 0 0 0 32 47 1 0 0 0 0 M END