IFLAB-ZINC04850966 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 3.3810 -0.1560 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -1.1670 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -2.5180 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -3.4560 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -3.0630 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.7010 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -0.7650 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -4.1080 -0.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3150 -5.0790 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -3.8830 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -5.0700 0.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -5.7970 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -5.5670 -1.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 -6.9920 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5850 -7.1870 0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -7.7580 -1.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -9.0110 -1.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0010 -9.4770 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6600 -8.7660 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -9.9120 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -10.8810 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -11.6630 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 -11.4830 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -10.5290 -4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -9.7450 -3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -5.1680 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -5.5010 -3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -3.4320 -4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -3.0490 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -4.6390 -6.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 0.2280 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 0.6810 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -0.6010 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -2.8510 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -4.4990 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -1.3370 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 0.2850 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -3.5460 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -3.1130 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -5.3850 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -7.4240 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -9.7120 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 -8.1950 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 -8.1880 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -11.0260 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -12.4110 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -12.0880 -5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -10.3950 -6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -8.9940 -4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -6.0870 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -4.6170 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -6.0840 -4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -6.1400 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -3.9320 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -2.5070 -4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.4640 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -2.4820 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -5.2110 -6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -5.2330 -6.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -3.7350 -6.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -4.3050 -1.8500 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6480 -4.8530 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -4.2890 -4.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 61 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 61 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 63 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 61 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 63 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END