IBS-ZINC04098359 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -0.0120 1.4920 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0120 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -0.6430 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 0.1240 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -0.4910 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -1.5020 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -2.0790 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -1.6520 2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 -0.6340 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -0.0420 2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 0.9550 2.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 1.0800 3.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6470 0.2260 4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 1.1220 4.7750 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1440 1.9820 4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 -0.1700 4.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.7800 5.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 1.2040 6.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 2.3510 4.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 2.3890 5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 3.5530 5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 4.6830 4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 4.6420 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 3.4770 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 5.8290 4.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 -2.2120 3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -1.9300 -0.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 -2.9720 -1.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9970 -3.8230 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -3.4040 -2.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9930 -2.5440 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 -4.4790 -3.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7690 -5.3580 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 -3.9230 -2.8080 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4750 -3.0730 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 -3.4700 -1.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3670 -4.3280 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -2.4940 -1.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8710 -2.8580 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 -2.5420 0.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2800 -4.9400 -3.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -4.8380 -4.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -3.9350 -2.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -0.7900 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 1.9140 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 1.8400 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 1.8110 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.7130 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 0.0850 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 1.1620 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8070 -2.8630 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 1.2350 6.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.5090 5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 3.5830 6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 5.5200 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 3.4460 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 6.4160 5.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 -1.7680 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6300 -3.5720 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9530 -1.9490 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9260 -2.1500 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 -5.2770 -4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 -5.1920 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -3.3080 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.9200 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -1.7670 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.2460 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 38 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 43 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 42 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 41 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 39 40 1 0 0 0 0 39 59 1 0 0 0 0 39 60 1 0 0 0 0 40 61 1 0 0 0 0 41 62 1 0 0 0 0 42 63 1 0 0 0 0 43 64 1 0 0 0 0 44 65 1 0 0 0 0 44 66 1 0 0 0 0 44 67 1 0 0 0 0 M END