IBS-ZINC02246943 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -3.9860 -2.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -4.7690 -3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -6.1140 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -6.1600 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -4.7590 -1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -4.4780 -1.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -5.4700 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 -5.1780 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 -6.1920 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -7.5230 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -7.8450 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -6.8240 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -7.1280 -1.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -7.2570 -3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -7.7210 -4.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -7.7970 -2.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -8.9430 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -9.3520 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -8.7940 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -9.1690 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -10.1020 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -10.6610 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -10.2900 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -10.5110 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -4.2980 -3.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -4.1520 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 -5.9610 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 -8.3100 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 -8.8800 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -7.4270 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -8.6670 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -9.7760 -3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -8.0640 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -8.7320 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -11.3910 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -10.7290 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -11.3630 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -10.7870 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -9.6770 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -3.3430 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -4.9210 -4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 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 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END