IFLAB-ZINC00704054 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 69 0 0 0 0 0 0 0 0999 V2000 -0.7820 1.9270 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 0.4530 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -0.2860 -0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -1.6470 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -2.3210 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -3.7150 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -4.4590 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -3.7830 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.3840 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -5.8590 -0.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -6.8020 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -6.5820 -0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -8.2040 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -9.2110 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -10.6070 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -10.9680 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -12.2950 -1.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -13.2190 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -14.6380 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -15.6090 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -15.2920 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -14.0150 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -12.9700 -0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -11.6610 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -11.3490 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -9.9480 -1.5810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -8.5940 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -10.3860 -2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -10.8290 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 -11.8600 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1770 -12.8330 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6210 -14.1270 -1.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6320 -14.0800 -2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -13.1750 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 2.5410 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 2.2380 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 2.1230 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.2830 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.1660 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 -1.7550 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -4.2080 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -4.3130 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -1.9090 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -6.2560 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -9.0050 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -14.8470 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -16.6530 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -16.1040 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -13.7540 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 -9.6030 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -11.1890 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -11.3390 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -9.9450 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5050 -10.8530 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6280 -12.2080 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9420 -12.9430 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 -12.4680 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -15.1000 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -13.7440 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -13.5370 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 -13.1030 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -7.6020 -1.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -7.9110 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -11.7710 -1.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.4100 -11.3880 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 62 2 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 34 64 1 0 0 0 0 62 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END