IBS-ZINC04028975 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 0.1590 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -0.4620 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -1.8570 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.6180 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9970 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -2.7480 -0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -3.1240 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.9760 -2.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -4.5460 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 0.3540 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.5660 -4.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -0.2460 -5.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 0.6180 -6.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -0.2360 -7.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4440 -0.9390 -7.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -1.0040 -6.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -0.0340 -6.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 0.9330 -7.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 0.6590 -8.5130 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1870 0.0620 -9.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 1.5320 -9.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 2.8580 -9.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8470 3.6950 -8.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 2.6660 -8.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 3.0870 -11.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 4.3990 -11.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 4.6280 -12.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 4.7030 -13.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 3.3910 -13.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 3.1620 -11.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.2370 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.3390 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -3.7190 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -2.2280 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -3.7110 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -4.2120 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -5.6340 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -4.2280 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 1.2390 -6.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 1.2560 -5.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -1.6070 -5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 -1.6590 -7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 0.5370 -5.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 -0.6000 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5890 1.6510 -7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 0.3740 -8.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 1.0650 -10.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 1.7120 -8.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 2.3100 -9.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 3.5970 -8.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 2.2620 -11.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 5.2240 -10.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 4.3450 -10.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 5.5620 -13.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 3.8030 -13.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 5.5280 -12.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 4.8660 -14.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 3.4450 -13.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 2.5660 -13.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 2.2280 -11.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 3.9880 -11.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 1.6320 -7.9120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 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 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 68 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 68 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 68 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 M END