IFLAB-ZINC02699172 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 0.6670 1.1090 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 1.1730 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.7370 3.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 1.2360 3.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 1.6320 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 1.0680 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 1.6680 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 0.7470 5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -0.6350 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -1.5050 6.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -1.0280 7.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 0.3260 7.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 1.2380 6.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 3.4330 6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 3.0360 5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 4.0430 4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 4.4560 4.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 4.5510 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 5.4040 2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 5.8760 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 5.5050 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 4.6570 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 4.1760 2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 5.9730 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 5.5530 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -1.8940 8.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -3.2310 7.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -3.7170 7.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -2.8430 6.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 0.0220 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 1.5480 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 1.4150 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 1.5660 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 0.0850 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 1.4200 4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 2.8260 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 1.2390 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 2.7200 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -0.0210 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 1.3840 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -1.0110 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 0.6840 8.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 4.4850 6.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 5.6930 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 6.5350 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 4.3720 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 3.5130 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 5.9980 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 4.4670 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 5.8740 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -3.8790 8.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -3.2440 6.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -3.6920 7.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -4.7340 6.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 1.5690 1.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 2.5580 6.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 55 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 56 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 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 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END