OTAVA-ZINC06143954 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 1.2060 0.1640 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 0.4620 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -0.2140 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 0.0290 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.6540 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -1.5950 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -1.8360 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.1440 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -2.3280 -4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -3.6770 -4.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -1.6370 -5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -0.2450 -5.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 0.0470 -7.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 1.1580 -7.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 -1.1000 -7.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -2.2280 -6.8510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8570 -2.8560 -7.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -3.0380 -6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 -2.4010 -6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 -3.1410 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -4.5190 -6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -5.1610 -6.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -4.4150 -6.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -6.5160 -6.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 -7.1980 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 -7.1090 -4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 -7.8030 -4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2330 -8.5870 -5.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7660 -8.6780 -6.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6290 -7.9890 -6.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 -1.2060 -9.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -1.2160 -9.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 -1.5720 -10.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5490 -1.7350 -11.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 -0.5680 -12.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -0.2950 -12.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -0.1170 -11.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 0.5820 -4.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.8910 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 0.3840 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 0.7720 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 0.7550 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.4650 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -2.5620 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -1.3260 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -1.3240 -6.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1450 -2.6410 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -5.0970 -5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -4.9120 -6.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 -6.4960 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9330 -7.7340 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1200 -9.1290 -4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 -9.2900 -7.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 -8.0640 -7.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 -2.1300 -9.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 -0.3550 -9.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 -0.2920 -8.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 -2.0670 -8.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 -2.4830 -9.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 -0.7310 -9.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6310 -1.8640 -11.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 -2.6090 -12.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 0.6180 -13.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 -1.1270 -13.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 0.7480 -10.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 0.0350 -11.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -4.0690 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 -1.3220 -10.3640 N 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 1 0 0 0 0 9 11 2 0 0 0 0 10 67 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 2 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 M END