OTAVA-ZINC06143953 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 1 0 0 0 0 0999 V2000 -3.7980 -1.0640 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -1.4680 -2.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.7120 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -2.1760 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.4730 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -2.2940 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -1.8360 -4.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -1.5430 -4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -2.6350 -4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -3.4940 -3.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -1.8760 -5.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -2.4440 -6.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -1.3610 -7.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -1.5270 -8.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -0.1850 -6.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -0.3930 -5.6380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1910 0.1200 -5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 0.1150 -4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -0.4240 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 0.0870 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 1.1460 -2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 1.6790 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 1.1790 -3.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 2.7560 -1.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 2.7220 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 3.8770 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 3.9150 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 2.8050 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 1.6590 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 1.6180 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 1.1140 -7.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 1.6770 -8.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 3.7280 -9.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 5.0730 -10.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 4.8950 -11.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 4.2940 -10.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 2.9070 -10.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -3.7490 -7.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -0.0990 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -1.8300 -4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -0.9390 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -2.3180 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -2.8450 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.7270 -6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -1.1990 -5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.2470 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 -0.3410 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 1.5450 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 1.6280 -3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 4.7430 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 4.8100 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 2.8360 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 0.7990 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 0.7290 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 1.8050 -6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 0.9690 -8.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 1.0020 -9.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 1.8350 -7.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 3.8620 -8.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 3.0670 -10.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 5.5590 -10.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 5.7470 -9.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 4.2090 -11.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 4.9540 -9.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 2.2350 -10.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 2.4810 -9.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -3.7930 -8.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 3.0180 -8.9890 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8400 3.6110 -8.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 49 1 0 0 0 0 24 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 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 68 1 0 0 0 0 34 35 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 37 68 1 0 0 0 0 38 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END