OTAVA-ZINC05016606 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.2970 1.9160 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.4710 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.2460 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 0.3160 -2.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.7520 -1.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3800 -2.0610 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -2.2590 -1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -4.0730 -1.8610 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -4.2830 -3.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8000 -5.3110 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -3.3470 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -3.6150 -3.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -2.2610 -1.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -3.9660 -4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -4.9780 -4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -5.8650 -4.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -4.8960 -6.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -5.8980 -6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -5.5750 -7.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -6.5620 -7.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -7.8780 -7.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -8.2000 -6.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -7.2140 -6.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 -9.1370 -7.9290 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -10.6330 -7.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -10.8400 -7.5900 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -10.4770 -5.7600 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 2.2460 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 2.2160 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 2.3730 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -1.9740 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -1.8320 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -1.7220 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.9680 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -4.0050 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -4.1440 -6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -4.5520 -7.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -6.3100 -8.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -9.2230 -6.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -7.4650 -5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -11.4900 -7.4230 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 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 36 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 41 1 0 0 0 0 M END