IBS-ZINC05345869 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8450 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.5950 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.6510 3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.9640 2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.2240 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1720 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.1220 -0.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.8900 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7990 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3270 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 0.8660 -2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.2150 -3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.7440 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -1.8100 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.3390 -7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.0540 -6.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.4880 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.7880 -9.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -0.7990 -9.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 0.3590 -9.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 0.3490 -9.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -0.8200 -10.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -1.9790 -10.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -1.9670 -9.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.4120 4.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -2.5520 5.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.4210 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -3.7830 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -4.2450 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.1660 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 0.1790 -4.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -1.9670 -5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.7450 -5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -0.4120 -7.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -2.1020 -7.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 0.1150 -7.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 0.8660 -6.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -1.4010 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.3010 -4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -1.5300 -9.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 0.2000 -9.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 1.2730 -8.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 1.2540 -9.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -0.8290 -10.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 -2.8920 -10.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -2.8710 -9.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -3.1630 5.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -3.1400 5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.2210 6.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -1.1080 -7.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 55 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 45 1 0 0 0 0 20 46 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END