IBS-ZINC04082065 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 1.0290 -0.4790 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.2100 0.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0080 0.8750 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -0.6350 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 0.4000 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 0.0730 2.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -1.0090 1.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -0.8780 -1.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5230 -0.6100 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.4190 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -2.8580 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -1.6990 -2.9220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9570 -1.7440 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.4500 -2.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8950 -0.1870 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.1070 -4.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -1.3710 -5.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3460 -2.2000 -5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -1.6900 -4.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2300 -0.8620 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -2.9540 -4.7990 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1840 -3.0440 -4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -2.8950 -6.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -2.6300 -7.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9320 -3.4480 -7.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -1.2970 -6.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2810 -1.1810 -7.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -1.2890 -9.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -2.5220 -9.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4050 -2.4280 -10.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -2.7250 -8.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -3.6840 -9.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -3.7510 -8.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.0630 -7.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -4.1580 -4.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -4.0770 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 0.8100 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -1.5440 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.1560 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 0.0700 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.7930 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.5980 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 0.5360 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 1.3670 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -2.8590 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -2.7910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -3.0300 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -3.7970 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 0.7470 -3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.9730 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 0.7880 -5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 0.0370 -5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -3.8530 -6.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -2.1250 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.2250 -7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -1.9640 -7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -0.3880 -9.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -1.3060 -9.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -3.7150 -8.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -1.9920 -8.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 0.8730 -7.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -0.0450 -8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -0.0200 -6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.6750 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 1.0760 -3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 0.6840 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 0.9490 2.8950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 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 5 44 1 0 0 0 0 6 7 2 0 0 0 0 6 67 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 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 23 1 0 0 0 0 21 35 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 M CHG 1 67 -1 M END