IBS-ZINC04040310 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 75 0 0 1 0 0 0 0 0999 V2000 -0.1620 1.7660 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.2480 -0.7310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0840 0.0380 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -1.4440 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -2.0080 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -1.8520 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.3700 -2.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2540 0.1580 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -0.2320 -3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.9900 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -0.4120 -1.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2270 -1.1080 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.3670 -0.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0870 -1.4410 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 0.2220 1.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8910 0.4480 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 1.4890 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 1.4810 -0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1290 0.9370 -1.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4990 1.6550 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 0.6750 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 0.0060 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 0.5550 0.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5060 -0.2590 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 1.3470 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0510 0.4730 1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 1.2870 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8020 2.1650 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 2.3890 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 1.9630 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 2.9150 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -0.7690 1.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -3.3770 -0.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -3.4740 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -2.3530 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -1.3350 -1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 2.1750 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9720 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 2.2270 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 0.5660 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 0.4620 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.5610 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -1.9820 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -2.2600 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.3970 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 0.8120 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -0.6700 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -0.9050 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -2.0470 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 1.6540 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 2.3580 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 1.6010 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 0.0000 -3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 0.2630 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -1.0780 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0920 0.6690 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 1.9010 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9500 1.6320 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 3.1090 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 2.5430 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 2.6150 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 1.1690 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 3.5800 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 2.9330 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 3.2470 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -0.4660 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -3.2590 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -4.4440 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -2.0500 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -2.6320 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 35 36 1 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 M END