IBS-ZINC02292511 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 1.0420 1.8090 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 0.3120 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.2880 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.6600 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -2.4370 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.8380 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.4580 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.1970 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -2.6210 -2.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -3.5910 -2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -4.3730 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -4.0810 -4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -3.2990 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -5.8740 -5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -6.7400 -5.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -6.7540 -4.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -7.5360 -6.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -7.1820 -7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -8.2020 -8.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -8.1870 -9.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -9.2700 -8.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -8.9070 -6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -9.8000 -6.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -11.0430 -6.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -11.4030 -7.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -10.5300 -8.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -5.8580 -7.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 2.0740 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 2.1540 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 2.2820 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 0.3180 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -2.1260 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.5090 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 0.2580 -3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -0.3940 -3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 1.2000 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -3.0640 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -4.2820 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -3.6850 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -5.1130 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -4.6080 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -3.3900 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -3.9870 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -2.5590 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -6.5070 -5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -5.2270 -6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -9.5220 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -11.7390 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -12.3780 -8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -10.8200 -9.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -5.1640 -8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -6.0000 -8.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -5.4530 -6.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -5.0510 -4.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 54 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 27 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 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END