OTAVA-ZINC05550622 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.3520 0.9900 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4040 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.7640 1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.9820 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.8130 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.0520 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -4.4650 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -3.6420 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.4000 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -1.5660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -2.0970 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -3.3020 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -1.1950 -0.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3890 -0.5620 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 -0.3180 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 -2.0090 -0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7170 -2.8790 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 -3.6200 -1.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7810 -3.5650 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6850 -2.7000 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -1.8960 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3680 -1.1200 1.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8440 -2.7620 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7750 -3.6320 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3010 -4.4430 -0.3800 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.0780 -3.8880 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9560 -3.3340 3.2630 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.2570 -3.9460 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4390 -1.8940 3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9730 -1.9090 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3280 -3.3560 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.2640 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 1.7130 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 0.9860 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.4000 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.1270 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.4930 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -4.6980 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -5.4340 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 -3.9670 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -0.6060 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 -0.9500 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 0.3350 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 0.2880 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -2.9560 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8960 -3.3880 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2700 -4.9600 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0290 -1.3300 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5200 -1.4290 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3580 -2.3330 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6460 -0.8920 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6970 -4.3800 3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2390 -2.9610 4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0240 -2.7410 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END